diethyl 4-ethanoyl-1-(2-nitrophenyl)carbonyl-3H-pyrrole-2,2-dicarboxylate

Systemtic Name: diethyl 4-ethanoyl-1-(2-nitrophenyl)carbonyl-3H-pyrrole-2,2-dicarboxylate Openeye Name: diethyl 4-acetyl-1-(2-nitrobenzoyl)-3H-pyrrole-2,2-dicarboxylate CAS Name: 4-acetyl-1-[(2-nitrophenyl)-oxomethyl]-3H-pyrrole-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-acetyl-1-(2-nitrobenzoyl)-3H-pyrrole-2,2-dicarboxylate Traditional Name: 4-acetyl-1-(2-nitrobenzoyl)-2-pyrroline-2,2-dicarboxylic acid diethyl ester Formula: C19H20N2O8 MolecularWeight: 404.3707

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(=CN1C(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC(=CN1C(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)C)C(=O)OCC

InChI

InChI=1S/C19H20N2O8/c1-4-28-17(24)19(18(25)29-5-2)10-13(12(3)22)11-20(19)16(23)14-8-6-7-9-15(14)21(26)27/h6-9,11H,4-5,10H2,1-3H3