2-(3-methylbutylamino)-4-[(3-methylphenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-(3-methylbutylamino)-4-[(3-methylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 2-(isopentylamino)-4-(3-methylanilino)-4-oxo-butanoic acid CAS Name: 4-(3-methylanilino)-2-(3-methylbutylamino)-4-oxobutanoic acid IUPAC Name: 4-(3-methylanilino)-2-(3-methylbutylamino)-4-oxobutanoic acid Traditional Name: 2-(isoamylamino)-4-keto-4-(m-toluidino)butyric acid Formula: C16H24N2O3 MolecularWeight: 292.37336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CC(C(=O)O)NCCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CC(C(=O)O)NCCC(C)C

InChI

InChI=1S/C16H24N2O3/c1-11(2)7-8-17-14(16(20)21)10-15(19)18-13-6-4-5-12(3)9-13/h4-6,9,11,14,17H,7-8,10H2,1-3H3,(H,18,19)(H,20,21)