5-(2-chlorophenyl)sulfanyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 5-(2-chlorophenyl)sulfanyl-1H-pyrrole-2-carboxylic acid Openeye Name: 5-(2-chlorophenyl)sulfanyl-1H-pyrrole-2-carboxylic acid CAS Name: 5-[(2-chlorophenyl)thio]-1H-pyrrole-2-carboxylic acid IUPAC Name: 5-(2-chlorophenyl)sulfanyl-1H-pyrrole-2-carboxylic acid Traditional Name: 5-[(2-chlorophenyl)thio]-1H-pyrrole-2-carboxylic acid Formula: C11H8ClNO2S MolecularWeight: 253.70472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SC2=CC=C(N2)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)SC2=CC=C(N2)C(=O)O)Cl

InChI

InChI=1S/C11H8ClNO2S/c12-7-3-1-2-4-9(7)16-10-6-5-8(13-10)11(14)15/h1-6,13H,(H,14,15)