[4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: [4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: [4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 1-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-methyl-4-nitro-2-pyrrolecarboxylic acid [4-[(4-methoxyanilino)-oxomethyl]phenyl]methyl ester IUPAC Name: [4-[(4-methoxyphenyl)carbamoyl]phenyl]methyl 1-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-methyl-4-nitro-pyrrole-2-carboxylic acid [4-[(4-methoxyphenyl)carbamoyl]benzyl] ester Formula: C21H19N3O6 MolecularWeight: 409.39206

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O6/c1-23-12-17(24(27)28)11-19(23)21(26)30-13-14-3-5-15(6-4-14)20(25)22-16-7-9-18(29-2)10-8-16/h3-12H,13H2,1-2H3,(H,22,25)