2-[5-(3,4-dichlorophenyl)sulfanyl-1H-pyrrol-3-yl]ethanoic acid

Systemtic Name: 2-[5-(3,4-dichlorophenyl)sulfanyl-1H-pyrrol-3-yl]ethanoic acid Openeye Name: 2-[5-(3,4-dichlorophenyl)sulfanyl-1H-pyrrol-3-yl]acetic acid CAS Name: 2-[5-[(3,4-dichlorophenyl)thio]-1H-pyrrol-3-yl]acetic acid IUPAC Name: 2-[5-(3,4-dichlorophenyl)sulfanyl-1H-pyrrol-3-yl]acetic acid Traditional Name: 2-[5-[(3,4-dichlorophenyl)thio]-1H-pyrrol-3-yl]acetic acid Formula: C12H9Cl2NO2S MolecularWeight: 302.17636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SC2=CC(=CN2)CC(=O)O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1SC2=CC(=CN2)CC(=O)O)Cl)Cl

InChI

InChI=1S/C12H9Cl2NO2S/c13-9-2-1-8(5-10(9)14)18-11-3-7(6-15-11)4-12(16)17/h1-3,5-6,15H,4H2,(H,16,17)