4-[2-(4-chlorophenyl)phenyl]carbonyl-2-phenylsulfanyl-cyclopentane-1-carboxylic acid

Systemtic Name: 4-[2-(4-chlorophenyl)phenyl]carbonyl-2-phenylsulfanyl-cyclopentane-1-carboxylic acid Openeye Name: 4-[2-(4-chlorophenyl)benzoyl]-2-phenylsulfanyl-cyclopentanecarboxylic acid CAS Name: 4-[[2-(4-chlorophenyl)phenyl]-oxomethyl]-2-(phenylthio)-1-cyclopentanecarboxylic acid IUPAC Name: 4-[2-(4-chlorophenyl)benzoyl]-2-phenylsulfanylcyclopentane-1-carboxylic acid Traditional Name: 4-[2-(4-chlorophenyl)benzoyl]-2-(phenylthio)cyclopentanecarboxylic acid Formula: C25H21ClO3S MolecularWeight: 436.95044

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(C1C(=O)O)SC2=CC=CC=C2)C(=O)C3=CC=CC=C3C4=CC=C(C=C4)Cl

Isomeric SMILES

C1C(CC(C1C(=O)O)SC2=CC=CC=C2)C(=O)C3=CC=CC=C3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClO3S/c26-18-12-10-16(11-13-18)20-8-4-5-9-21(20)24(27)17-14-22(25(28)29)23(15-17)30-19-6-2-1-3-7-19/h1-13,17,22-23H,14-15H2,(H,28,29)