2-[(4-methylphenyl)sulfonyloxymethyl]-5-(4-phenylphenyl)sulfanyl-cyclopentane-1-carboxylic acid

Systemtic Name: 2-[(4-methylphenyl)sulfonyloxymethyl]-5-(4-phenylphenyl)sulfanyl-cyclopentane-1-carboxylic acid Openeye Name: 2-(4-phenylphenyl)sulfanyl-5-(p-tolylsulfonyloxymethyl)cyclopentanecarboxylic acid CAS Name: 2-[(4-methylphenyl)sulfonyloxymethyl]-5-[(4-phenylphenyl)thio]-1-cyclopentanecarboxylic acid IUPAC Name: 2-[(4-methylphenyl)sulfonyloxymethyl]-5-(4-phenylphenyl)sulfanylcyclopentane-1-carboxylic acid Traditional Name: 2-[(4-phenylphenyl)thio]-5-(tosyloxymethyl)cyclopentanecarboxylic acid Formula: C26H26O5S2 MolecularWeight: 482.61164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC(C2C(=O)O)SC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC(C2C(=O)O)SC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H26O5S2/c1-18-7-14-23(15-8-18)33(29,30)31-17-21-11-16-24(25(21)26(27)28)32-22-12-9-20(10-13-22)19-5-3-2-4-6-19/h2-10,12-15,21,24-25H,11,16-17H2,1H3,(H,27,28)