2-[[3-(aminomethyl)phenyl]carbonyl-(4-methylphenyl)amino]ethanoic acid

Systemtic Name: 2-[[3-(aminomethyl)phenyl]carbonyl-(4-methylphenyl)amino]ethanoic acid Openeye Name: 2-(N-[3-(aminomethyl)benzoyl]-4-methyl-anilino)acetic acid CAS Name: 2-(N-[[3-(aminomethyl)phenyl]-oxomethyl]-4-methylanilino)acetic acid IUPAC Name: 2-(N-[3-(aminomethyl)benzoyl]-4-methylanilino)acetic acid Traditional Name: 2-(N-[3-(aminomethyl)benzoyl]-4-methyl-anilino)acetic acid Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)O)C(=O)C2=CC(=CC=C2)CN

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)O)C(=O)C2=CC(=CC=C2)CN

InChI

InChI=1S/C17H18N2O3/c1-12-5-7-15(8-6-12)19(11-16(20)21)17(22)14-4-2-3-13(9-14)10-18/h2-9H,10-11,18H2,1H3,(H,20,21)