2-[3-ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol (CHEBI:73970)

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ChEBI Name	2-[3-ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol

ChEBI ID	CHEBI:73970

ChEBI ASCII Name	2-[3-ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol

Definition	A pyrazole that is 1H-pyrazole bearing an ethyl group at position 3, a 2-hydroxyphenyl group at position 2, and a 4-methoxyphenyl group at position 5.

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

Supplier Information

Download	Molfile XML SDF

Formula

C18H18N2O2

Net Charge

Average Mass

294.34770

Monoisotopic Mass

294.13683

InChI

InChI=1S/C18H18N2O2/c1-3-15-17(14-6-4-5-7-16(14)21)18(20-19-15)12-8-10-13(22-2)11-9-12/h4-11,21H,3H2,1-2H3,(H,19,20)

InChIKey

ODGRMKHYFIFZML-UHFFFAOYSA-N

SMILES

CCc1n[nH]c(-c2ccc(OC)cc2)c1-c1ccccc1O

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	2-[3-ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol (CHEBI:73970) has role metabolite (CHEBI:25212) 2-[3-ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol (CHEBI:73970) is a monomethoxybenzene (CHEBI:25235) 2-[3-ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol (CHEBI:73970) is a phenols (CHEBI:33853) 2-[3-ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol (CHEBI:73970) is a pyrazoles (CHEBI:26410)

IUPAC Name

2-[3-ethyl-5-(4-methoxyphenyl)-1H-pyrazol-4-yl]phenol

Last Modified

28 July 2014