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

Systemtic Name: methyl 2,4-dicyano-5-oxidanylidene-3-phenyl-5-[2-(phenylcarbonyl)hydrazinyl]pentanoate Openeye Name: methyl 5-(2-benzoylhydrazino)-2,4-dicyano-5-oxo-3-phenyl-pentanoate CAS Name: 5-(benzoylhydrazo)-2,4-dicyano-5-oxo-3-phenylpentanoic acid methyl ester IUPAC Name: methyl 5-(2-benzoylhydrazinyl)-2,4-dicyano-5-oxo-3-phenylpentanoate Traditional Name: 5-(N'-benzoylhydrazino)-2,4-dicyano-5-keto-3-phenyl-valeric acid methyl ester Formula: C21H18N4O4 MolecularWeight: 390.39202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N4O4/c1-29-21(28)17(13-23)18(14-8-4-2-5-9-14)16(12-22)20(27)25-24-19(26)15-10-6-3-7-11-15/h2-11,16-18H,1H3,(H,24,26)(H,25,27)