methyl 4-[(2,5-dimethylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[(2,5-dimethylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-(2,5-dimethylanilino)-4-oxo-butanoate CAS Name: 4-(2,5-dimethylanilino)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(2,5-dimethylanilino)-4-oxobutanoate Traditional Name: 4-(2,5-dimethylanilino)-4-keto-butyric acid methyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3/c1-9-4-5-10(2)11(8-9)14-12(15)6-7-13(16)17-3/h4-5,8H,6-7H2,1-3H3,(H,14,15)