2-[(3-cyanophenyl)-phenethyl-amino]butanoic acid

Systemtic Name: 2-[(3-cyanophenyl)-phenethyl-amino]butanoic acid Openeye Name: 2-(3-cyano-N-phenethyl-anilino)butanoic acid CAS Name: 2-(3-cyano-N-phenethylanilino)butanoic acid IUPAC Name: 2-(3-cyano-N-phenethylanilino)butanoic acid Traditional Name: 2-(3-cyano-N-phenethyl-anilino)butyric acid Formula: C19H20N2O2 MolecularWeight: 308.3743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N(CCC1=CC=CC=C1)C2=CC=CC(=C2)C#N

Isomeric SMILES

CCC(C(=O)O)N(CCC1=CC=CC=C1)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H20N2O2/c1-2-18(19(22)23)21(12-11-15-7-4-3-5-8-15)17-10-6-9-16(13-17)14-20/h3-10,13,18H,2,11-12H2,1H3,(H,22,23)