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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CC(=O)NC1=CC(=C(C=C1)C)C)C(=O)O

Isomeric SMILES

CCCCNC(CC(=O)NC1=CC(=C(C=C1)C)C)C(=O)O

InChI

InChI=1S/C16H24N2O3/c1-4-5-8-17-14(16(20)21)10-15(19)18-13-7-6-11(2)12(3)9-13/h6-7,9,14,17H,4-5,8,10H2,1-3H3,(H,18,19)(H,20,21)