(2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl) 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: (2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl) 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: (2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl) 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid [2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl) 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid (2-keto-1-phenyl-2-pyrrolidino-ethyl) ester Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5/c1-19-12-14(21(24)25)11-15(19)18(23)26-16(13-7-3-2-4-8-13)17(22)20-9-5-6-10-20/h2-4,7-8,11-12,16H,5-6,9-10H2,1H3