4-[(2-methylphenyl)amino]-4-oxidanylidene-2-[(phenylmethyl)amino]butanoic acid

Systemtic Name: 4-[(2-methylphenyl)amino]-4-oxidanylidene-2-[(phenylmethyl)amino]butanoic acid Openeye Name: 2-(benzylamino)-4-(2-methylanilino)-4-oxo-butanoic acid CAS Name: 4-(2-methylanilino)-4-oxo-2-[(phenylmethyl)amino]butanoic acid IUPAC Name: 2-(benzylamino)-4-(2-methylanilino)-4-oxobutanoic acid Traditional Name: 2-(benzylamino)-4-keto-4-(o-toluidino)butyric acid Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CC(C(=O)O)NCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CC(C(=O)O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O3/c1-13-7-5-6-10-15(13)20-17(21)11-16(18(22)23)19-12-14-8-3-2-4-9-14/h2-10,16,19H,11-12H2,1H3,(H,20,21)(H,22,23)