2-[5-(4-chlorophenyl)carbonyl-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid

Systemtic Name: 2-[5-(4-chlorophenyl)carbonyl-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid Openeye Name: 2-[5-(4-chlorobenzoyl)-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid CAS Name: 2-[5-[(4-chlorophenyl)-oxomethyl]-2,3-dihydropyrrol-1-yl]-1-pyrrolecarboxylic acid IUPAC Name: 2-[5-(4-chlorobenzoyl)-2,3-dihydropyrrol-1-yl]pyrrole-1-carboxylic acid Traditional Name: 2-[2-(4-chlorobenzoyl)-2-pyrrolin-1-yl]pyrrole-1-carboxylic acid Formula: C16H13ClN2O3 MolecularWeight: 316.73902

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=C1)C(=O)C2=CC=C(C=C2)Cl)C3=CC=CN3C(=O)O

Isomeric SMILES

C1CN(C(=C1)C(=O)C2=CC=C(C=C2)Cl)C3=CC=CN3C(=O)O

InChI

InChI=1S/C16H13ClN2O3/c17-12-7-5-11(6-8-12)15(20)13-3-1-9-18(13)14-4-2-10-19(14)16(21)22/h2-8,10H,1,9H2,(H,21,22)