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

Systemtic Name: 4-[(3,5-dimethylphenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(3,5-dimethylanilino)-4-oxo-butanoic acid CAS Name: 4-(3,5-dimethylanilino)-4-oxobutanoic acid IUPAC Name: 4-(3,5-dimethylanilino)-4-oxobutanoic acid Traditional Name: 4-(3,5-dimethylanilino)-4-keto-butyric acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c1-8-5-9(2)7-10(6-8)13-11(14)3-4-12(15)16/h5-7H,3-4H2,1-2H3,(H,13,14)(H,15,16)