O1-ethyl O3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-(2-oxo-2-pyrrolidin-1-yl-ethyl) 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: 1-O-ethyl 3-O-(2-oxo-2-pyrrolidin-1-ylethyl) 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-(2-keto-2-pyrrolidino-ethyl) ester Formula: C16H18N2O7 MolecularWeight: 350.32332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O7/c1-2-24-15(20)11-7-12(9-13(8-11)18(22)23)16(21)25-10-14(19)17-5-3-4-6-17/h7-9H,2-6,10H2,1H3