ethyl 1-[2-(methylcarbamoyl)phenyl]-5-(4-nitrophenyl)carbonyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-(methylcarbamoyl)phenyl]-5-(4-nitrophenyl)carbonyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(methylcarbamoyl)phenyl]-5-(4-nitrobenzoyl)pyrrole-3-carboxylate CAS Name: 1-[2-(methylcarbamoyl)phenyl]-5-[(4-nitrophenyl)-oxomethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(methylcarbamoyl)phenyl]-5-(4-nitrobenzoyl)pyrrole-3-carboxylate Traditional Name: 1-[2-(methylcarbamoyl)phenyl]-5-(4-nitrobenzoyl)pyrrole-3-carboxylic acid ethyl ester Formula: C22H19N3O6 MolecularWeight: 421.40276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3C(=O)NC

Isomeric SMILES

CCOC(=O)C1=CN(C(=C1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3C(=O)NC

InChI

InChI=1S/C22H19N3O6/c1-3-31-22(28)15-12-19(20(26)14-8-10-16(11-9-14)25(29)30)24(13-15)18-7-5-4-6-17(18)21(27)23-2/h4-13H,3H2,1-2H3,(H,23,27)