methyl 4-(2-chlorophenyl)carbonyl-5-methyl-2-nitro-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(2-chlorophenyl)carbonyl-5-methyl-2-nitro-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-(2-chlorobenzoyl)-5-methyl-2-nitro-1H-pyrrole-3-carboxylate CAS Name: 4-[(2-chlorophenyl)-oxomethyl]-5-methyl-2-nitro-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-chlorobenzoyl)-5-methyl-2-nitro-1H-pyrrole-3-carboxylate Traditional Name: 4-(2-chlorobenzoyl)-5-methyl-2-nitro-1H-pyrrole-3-carboxylic acid methyl ester Formula: C14H11ClN2O5 MolecularWeight: 322.70054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)[N+](=O)[O-])C(=O)OC)C(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC1=C(C(=C(N1)[N+](=O)[O-])C(=O)OC)C(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C14H11ClN2O5/c1-7-10(12(18)8-5-3-4-6-9(8)15)11(14(19)22-2)13(16-7)17(20)21/h3-6,16H,1-2H3