(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 2-(4-chloro-3-nitro-benzoyl)benzoate CAS Name: 2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 2-(4-chloro-3-nitrobenzoyl)benzoate Traditional Name: 2-(4-chloro-3-nitro-benzoyl)benzoic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C20H17ClN2O6 MolecularWeight: 416.81178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)COC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H17ClN2O6/c21-16-8-7-13(11-17(16)23(27)28)19(25)14-5-1-2-6-15(14)20(26)29-12-18(24)22-9-3-4-10-22/h1-2,5-8,11H,3-4,9-10,12H2