(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4,5-dimethoxy-2-nitro-benzoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 4,5-dimethoxy-2-nitro-benzoate CAS Name: 4,5-dimethoxy-2-nitrobenzoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 4,5-dimethoxy-2-nitrobenzoate Traditional Name: 4,5-dimethoxy-2-nitro-benzoic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C15H18N2O7 MolecularWeight: 338.31262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)N2CCCC2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)N2CCCC2)[N+](=O)[O-])OC

InChI

InChI=1S/C15H18N2O7/c1-22-12-7-10(11(17(20)21)8-13(12)23-2)15(19)24-9-14(18)16-5-3-4-6-16/h7-8H,3-6,9H2,1-2H3