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

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 4-oxidanylidene-4-[2-(phenylcarbonyl)hydrazinyl]butanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 4-(2-benzoylhydrazino)-4-oxo-butanoate CAS Name: 4-(benzoylhydrazo)-4-oxobutanoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 4-(2-benzoylhydrazinyl)-4-oxobutanoate Traditional Name: 4-(N'-benzoylhydrazino)-4-keto-butyric acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O5/c1-14-8-9-17(12-15(14)2)18(24)13-28-20(26)11-10-19(25)22-23-21(27)16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H,22,25)(H,23,27)