ethyl 4-[(3-chlorophenyl)methyl]-2-methyl-5-(2-nitroethenyl)-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[(3-chlorophenyl)methyl]-2-methyl-5-(2-nitroethenyl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(3-chlorophenyl)methyl]-2-methyl-5-(2-nitrovinyl)-1H-pyrrole-3-carboxylate CAS Name: 4-[(3-chlorophenyl)methyl]-2-methyl-5-(2-nitroethenyl)-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-chlorophenyl)methyl]-2-methyl-5-(2-nitroethenyl)-1H-pyrrole-3-carboxylate Traditional Name: 4-(3-chlorobenzyl)-2-methyl-5-(2-nitrovinyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C17H17ClN2O4 MolecularWeight: 348.78088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1CC2=CC(=CC=C2)Cl)C=C[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1CC2=CC(=CC=C2)Cl)C=C[N+](=O)[O-])C

InChI

InChI=1S/C17H17ClN2O4/c1-3-24-17(21)16-11(2)19-15(7-8-20(22)23)14(16)10-12-5-4-6-13(18)9-12/h4-9,19H,3,10H2,1-2H3