2-(carboxymethyl)-5-(4-chlorophenyl)carbonyl-1,4-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 2-(carboxymethyl)-5-(4-chlorophenyl)carbonyl-1,4-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 2-(carboxymethyl)-5-(4-chlorobenzoyl)-1,4-dimethyl-pyrrole-3-carboxylic acid CAS Name: 2-(carboxymethyl)-5-[(4-chlorophenyl)-oxomethyl]-1,4-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 2-(carboxymethyl)-5-(4-chlorobenzoyl)-1,4-dimethylpyrrole-3-carboxylic acid Traditional Name: 2-(carboxymethyl)-5-(4-chlorobenzoyl)-1,4-dimethyl-pyrrole-3-carboxylic acid Formula: C16H14ClNO5 MolecularWeight: 335.73906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C(=O)O)CC(=O)O)C)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(N(C(=C1C(=O)O)CC(=O)O)C)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H14ClNO5/c1-8-13(16(22)23)11(7-12(19)20)18(2)14(8)15(21)9-3-5-10(17)6-4-9/h3-6H,7H2,1-2H3,(H,19,20)(H,22,23)