methyl 3-(4-chlorophenyl)-2,4-dicyano-5-oxidanylidene-5-[2-(phenylcarbonyl)hydrazinyl]pentanoate

Systemtic Name: methyl 3-(4-chlorophenyl)-2,4-dicyano-5-oxidanylidene-5-[2-(phenylcarbonyl)hydrazinyl]pentanoate Openeye Name: methyl 5-(2-benzoylhydrazino)-3-(4-chlorophenyl)-2,4-dicyano-5-oxo-pentanoate CAS Name: 5-(benzoylhydrazo)-3-(4-chlorophenyl)-2,4-dicyano-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(2-benzoylhydrazinyl)-3-(4-chlorophenyl)-2,4-dicyano-5-oxopentanoate Traditional Name: 5-(N'-benzoylhydrazino)-3-(4-chlorophenyl)-2,4-dicyano-5-keto-valeric acid methyl ester Formula: C21H17ClN4O4 MolecularWeight: 424.83708

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C(C1=CC=C(C=C1)Cl)C(C#N)C(=O)NNC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(C#N)C(C1=CC=C(C=C1)Cl)C(C#N)C(=O)NNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H17ClN4O4/c1-30-21(29)17(12-24)18(13-7-9-15(22)10-8-13)16(11-23)20(28)26-25-19(27)14-5-3-2-4-6-14/h2-10,16-18H,1H3,(H,25,27)(H,26,28)