[2-(4-chloranyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 5-oxidanylidene-5-[2-(phenylcarbonyl)hydrazinyl]pentanoate

Systemtic Name: [2-(4-chloranyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 5-oxidanylidene-5-[2-(phenylcarbonyl)hydrazinyl]pentanoate Openeye Name: [2-(4-chloro-3-nitro-phenyl)-2-oxo-ethyl] 5-(2-benzoylhydrazino)-5-oxo-pentanoate CAS Name: 5-(benzoylhydrazo)-5-oxopentanoic acid [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-nitrophenyl)-2-oxoethyl] 5-(2-benzoylhydrazinyl)-5-oxopentanoate Traditional Name: 5-(N'-benzoylhydrazino)-5-keto-valeric acid [2-(4-chloro-3-nitro-phenyl)-2-keto-ethyl] ester Formula: C20H18ClN3O7 MolecularWeight: 447.82582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NNC(=O)CCCC(=O)OCC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NNC(=O)CCCC(=O)OCC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN3O7/c21-15-10-9-14(11-16(15)24(29)30)17(25)12-31-19(27)8-4-7-18(26)22-23-20(28)13-5-2-1-3-6-13/h1-3,5-6,9-11H,4,7-8,12H2,(H,22,26)(H,23,28)