butamben (CHEBI:3231)

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ChEBI Name	butamben

ChEBI ID	CHEBI:3231

Definition	An amino acid ester resulting from the formal condensation of the carboxy group of 4-aminobenzoic acid with the hydroxy group of butan-1-ol. Its local anaesthetic properties have been used for surface anaesthesia of the skin and mucous membranes, and for relief of pain and itching associated with some anorectal disorders.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C11H15NO2

Net Charge

Average Mass

193.24230

Monoisotopic Mass

193.11028

InChI

InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7H,2-3,8,12H2,1H3

InChIKey

IUWVALYLNVXWKX-UHFFFAOYSA-N

SMILES

CCCCOC(=O)c1ccc(N)cc1

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Application(s):	local anaesthetic Any member of a group of drugs that reversibly inhibit the propagation of signals along nerves. Wide variations in potency, stability, toxicity, water-solubility and duration of action determine the route used for administration, e.g. topical, intravenous, epidural or spinal block.

ChEBI Ontology
Outgoing	butamben (CHEBI:3231) has functional parent 4-aminobenzoic acid (CHEBI:30753) butamben (CHEBI:3231) has functional parent butan-1-ol (CHEBI:28885) butamben (CHEBI:3231) has role local anaesthetic (CHEBI:36333) butamben (CHEBI:3231) is a amino acid ester (CHEBI:46668) butamben (CHEBI:3231) is a benzoate ester (CHEBI:36054) butamben (CHEBI:3231) is a primary amino compound (CHEBI:50994) butamben (CHEBI:3231) is a substituted aniline (CHEBI:48975) butamben (CHEBI:3231) is conjugate base of butamben(1+) (CHEBI:86302)

Incoming	butamben picrate (CHEBI:86300) has part butamben (CHEBI:3231) butamben(1+) (CHEBI:86302) is conjugate acid of butamben (CHEBI:3231)

IUPAC Name

butyl 4-aminobenzoate

Synonyms	Sources
4-(butoxycarbonyl)aniline	ChemIDplus
4-aminobenzoic acid butyl ester	ChemIDplus
BAB	ChEBI
butyl aminobenzoate	ChEBI
butyl p-aminobenzoate	ChemIDplus
n-butyl p-aminobenzoate	ChemIDplus
p-aminobenzoic acid butyl ester	ChemIDplus

Last Modified

22 February 2017