methyl 4-methyl-3-(3-nitrophenyl)-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-methyl-3-(3-nitrophenyl)-1H-pyrrole-2-carboxylate Openeye Name: methyl 4-methyl-3-(3-nitrophenyl)-1H-pyrrole-2-carboxylate CAS Name: 4-methyl-3-(3-nitrophenyl)-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-methyl-3-(3-nitrophenyl)-1H-pyrrole-2-carboxylate Traditional Name: 4-methyl-3-(3-nitrophenyl)-1H-pyrrole-2-carboxylic acid methyl ester Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC(=C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=CNC(=C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C13H12N2O4/c1-8-7-14-12(13(16)19-2)11(8)9-4-3-5-10(6-9)15(17)18/h3-7,14H,1-2H3