methyl 4-[2-(4-chloranyl-3-nitro-phenyl)carbonylhydrazinyl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[2-(4-chloranyl-3-nitro-phenyl)carbonylhydrazinyl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-(4-chloro-3-nitro-benzoyl)hydrazino]-4-oxo-butanoate CAS Name: 4-[[(4-chloro-3-nitrophenyl)-oxomethyl]hydrazo]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-(4-chloro-3-nitrobenzoyl)hydrazinyl]-4-oxobutanoate Traditional Name: 4-[N'-(4-chloro-3-nitro-benzoyl)hydrazino]-4-keto-butyric acid methyl ester Formula: C12H12ClN3O6 MolecularWeight: 329.69318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NNC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCC(=O)NNC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN3O6/c1-22-11(18)5-4-10(17)14-15-12(19)7-2-3-8(13)9(6-7)16(20)21/h2-3,6H,4-5H2,1H3,(H,14,17)(H,15,19)