3-[2,3-bis(chloranyl)-4-(phenylcarbonyl)phenyl]sulfanylcyclopentane-1-carboxylic acid

Systemtic Name: 3-[2,3-bis(chloranyl)-4-(phenylcarbonyl)phenyl]sulfanylcyclopentane-1-carboxylic acid Openeye Name: 3-(4-benzoyl-2,3-dichloro-phenyl)sulfanylcyclopentanecarboxylic acid CAS Name: 3-[(4-benzoyl-2,3-dichlorophenyl)thio]-1-cyclopentanecarboxylic acid IUPAC Name: 3-(4-benzoyl-2,3-dichlorophenyl)sulfanylcyclopentane-1-carboxylic acid Traditional Name: 3-[(4-benzoyl-2,3-dichloro-phenyl)thio]cyclopentanecarboxylic acid Formula: C19H16Cl2O3S MolecularWeight: 395.29954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC1C(=O)O)SC2=C(C(=C(C=C2)C(=O)C3=CC=CC=C3)Cl)Cl

Isomeric SMILES

C1CC(CC1C(=O)O)SC2=C(C(=C(C=C2)C(=O)C3=CC=CC=C3)Cl)Cl

InChI

InChI=1S/C19H16Cl2O3S/c20-16-14(18(22)11-4-2-1-3-5-11)8-9-15(17(16)21)25-13-7-6-12(10-13)19(23)24/h1-5,8-9,12-13H,6-7,10H2,(H,23,24)