methyl 4-(3-nitrophenyl)-5-pyridin-4-ylcarbonyl-2,5-dihydro-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-(3-nitrophenyl)-5-pyridin-4-ylcarbonyl-2,5-dihydro-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-(3-nitrophenyl)-5-(pyridine-4-carbonyl)-2,5-dihydro-1H-pyrrole-2-carboxylate CAS Name: 4-(3-nitrophenyl)-5-[oxo(pyridin-4-yl)methyl]-2,5-dihydro-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-nitrophenyl)-5-(pyridine-4-carbonyl)-2,5-dihydro-1H-pyrrole-2-carboxylate Traditional Name: 5-isonicotinoyl-4-(3-nitrophenyl)-3-pyrroline-2-carboxylic acid methyl ester Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C=C(C(N1)C(=O)C2=CC=NC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1C=C(C(N1)C(=O)C2=CC=NC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O5/c1-26-18(23)15-10-14(12-3-2-4-13(9-12)21(24)25)16(20-15)17(22)11-5-7-19-8-6-11/h2-10,15-16,20H,1H3