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

Systemtic Name: 4-[(3,5-dimethylphenyl)amino]-4-oxidanylidene-2-(propylamino)butanoic acid Openeye Name: 4-(3,5-dimethylanilino)-4-oxo-2-(propylamino)butanoic acid CAS Name: 4-(3,5-dimethylanilino)-4-oxo-2-(propylamino)butanoic acid IUPAC Name: 4-(3,5-dimethylanilino)-4-oxo-2-(propylamino)butanoic acid Traditional Name: 4-(3,5-dimethylanilino)-4-keto-2-(propylamino)butyric acid Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3/c1-4-5-16-13(15(19)20)9-14(18)17-12-7-10(2)6-11(3)8-12/h6-8,13,16H,4-5,9H2,1-3H3,(H,17,18)(H,19,20)