4-[(3,5-dimethylphenyl)amino]-2-(2-methylpropylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3,5-dimethylphenyl)amino]-2-(2-methylpropylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3,5-dimethylanilino)-2-(isobutylamino)-4-oxo-butanoic acid CAS Name: 4-(3,5-dimethylanilino)-2-(2-methylpropylamino)-4-oxobutanoic acid IUPAC Name: 4-(3,5-dimethylanilino)-2-(2-methylpropylamino)-4-oxobutanoic acid Traditional Name: 4-(3,5-dimethylanilino)-2-(isobutylamino)-4-keto-butyric acid Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O3/c1-10(2)9-17-14(16(20)21)8-15(19)18-13-6-11(3)5-12(4)7-13/h5-7,10,14,17H,8-9H2,1-4H3,(H,18,19)(H,20,21)