[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 4-[(3,4-dimethylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 4-[(3,4-dimethylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 4-(3,4-dimethylanilino)-4-oxo-butanoate CAS Name: 4-(3,4-dimethylanilino)-4-oxobutanoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 4-(3,4-dimethylanilino)-4-oxobutanoate Traditional Name: 4-(3,4-dimethylanilino)-4-keto-butyric acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)CCC(=O)NC2=CC(=C(C=C2)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)CCC(=O)NC2=CC(=C(C=C2)C)C)C

InChI

InChI=1S/C22H25NO4/c1-14-5-7-18(11-16(14)3)20(24)13-27-22(26)10-9-21(25)23-19-8-6-15(2)17(4)12-19/h5-8,11-12H,9-10,13H2,1-4H3,(H,23,25)