2-[3-(3-aminophenyl)-5-methyl-phenyl]-2-[(4-cyanophenyl)amino]ethanoic acid

Systemtic Name: 2-[3-(3-aminophenyl)-5-methyl-phenyl]-2-[(4-cyanophenyl)amino]ethanoic acid Openeye Name: 2-[3-(3-aminophenyl)-5-methyl-phenyl]-2-(4-cyanoanilino)acetic acid CAS Name: 2-[3-(3-aminophenyl)-5-methylphenyl]-2-(4-cyanoanilino)acetic acid IUPAC Name: 2-[3-(3-aminophenyl)-5-methylphenyl]-2-(4-cyanoanilino)acetic acid Traditional Name: 2-[3-(3-aminophenyl)-5-methyl-phenyl]-2-(4-cyanoanilino)acetic acid Formula: C22H19N3O2 MolecularWeight: 357.40516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=CC(=CC=C2)N)C(C(=O)O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=CC(=C1)C2=CC(=CC=C2)N)C(C(=O)O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H19N3O2/c1-14-9-17(16-3-2-4-19(24)12-16)11-18(10-14)21(22(26)27)25-20-7-5-15(13-23)6-8-20/h2-12,21,25H,24H2,1H3,(H,26,27)