[2-[2-(4-chlorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-nitro-4-pyrrolidin-1-yl-benzoate

Systemtic Name: [2-[2-(4-chlorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 3-nitro-4-pyrrolidin-1-yl-benzoate Openeye Name: [2-[2-(4-chlorobenzoyl)hydrazino]-2-oxo-ethyl] 3-nitro-4-pyrrolidin-1-yl-benzoate CAS Name: 3-nitro-4-(1-pyrrolidinyl)benzoic acid [2-[[(4-chlorophenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-chlorobenzoyl)hydrazinyl]-2-oxoethyl] 3-nitro-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-nitro-4-pyrrolidino-benzoic acid [2-[N'-(4-chlorobenzoyl)hydrazino]-2-keto-ethyl] ester Formula: C20H19ClN4O6 MolecularWeight: 446.84106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)OCC(=O)NNC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)OCC(=O)NNC(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClN4O6/c21-15-6-3-13(4-7-15)19(27)23-22-18(26)12-31-20(28)14-5-8-16(17(11-14)25(29)30)24-9-1-2-10-24/h3-8,11H,1-2,9-10,12H2,(H,22,26)(H,23,27)