ethyl 4-ethanoyl-2,5-dimethyl-1-[2-(4-nitrophenyl)ethanoylamino]pyrrole-3-carboxylate

Systemtic Name: ethyl 4-ethanoyl-2,5-dimethyl-1-[2-(4-nitrophenyl)ethanoylamino]pyrrole-3-carboxylate Openeye Name: ethyl 4-acetyl-2,5-dimethyl-1-[[2-(4-nitrophenyl)acetyl]amino]pyrrole-3-carboxylate CAS Name: 4-acetyl-2,5-dimethyl-1-[[2-(4-nitrophenyl)-1-oxoethyl]amino]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-2,5-dimethyl-1-[[2-(4-nitrophenyl)acetyl]amino]pyrrole-3-carboxylate Traditional Name: 4-acetyl-2,5-dimethyl-1-[[2-(4-nitrophenyl)acetyl]amino]pyrrole-3-carboxylic acid ethyl ester Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C(=O)C)C)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C(=O)C)C)NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N3O6/c1-5-28-19(25)18-12(3)21(11(2)17(18)13(4)23)20-16(24)10-14-6-8-15(9-7-14)22(26)27/h6-9H,5,10H2,1-4H3,(H,20,24)