CHEBI:104114 - N-[(3-chloro-5-ethoxy-4-phenylmethoxyphenyl)methyl]cyclopentanamine

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ChEBI Name N-[(3-chloro-5-ethoxy-4-phenylmethoxyphenyl)methyl]cyclopentanamine
ChEBI ID CHEBI:104114
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H26ClNO2
Net Charge 0
Average Mass 359.890
Monoisotopic Mass 359.16521
InChI InChI=1S/C21H26ClNO2/c1-2-24-20-13-17(14-23-18-10-6-7-11-18)12-19(22)21(20)25-15-16-8-4-3-5-9-16/h3-5,8-9,12-13,18,23H,2,6-7,10-11,14-15H2,1H3
InChIKey OXBGNWDZXDFSIY-UHFFFAOYSA-N
SMILES CCOC1=C(C(=CC(=C1)CNC2CCCC2)Cl)OCC3=CC=CC=C3
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing N-[(3-chloro-5-ethoxy-4-phenylmethoxyphenyl)methyl]cyclopentanamine (CHEBI:104114) is a aromatic amine (CHEBI:33860)
Manual Xref Database
LSM-15472 LINCS
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