2-(4-methylphenyl)sulfonyl-8-thiophen-2-yl-octanoic acid

Systemtic Name: 2-(4-methylphenyl)sulfonyl-8-thiophen-2-yl-octanoic acid Openeye Name: 2-(p-tolylsulfonyl)-8-(2-thienyl)octanoic acid CAS Name: 2-(4-methylphenyl)sulfonyl-8-thiophen-2-yloctanoic acid IUPAC Name: 2-(4-methylphenyl)sulfonyl-8-thiophen-2-yloctanoic acid Traditional Name: 8-(2-thienyl)-2-tosyl-caprylic acid Formula: C19H24O4S2 MolecularWeight: 380.52146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CCCCCCC2=CC=CS2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CCCCCCC2=CC=CS2)C(=O)O

InChI

InChI=1S/C19H24O4S2/c1-15-10-12-17(13-11-15)25(22,23)18(19(20)21)9-5-3-2-4-7-16-8-6-14-24-16/h6,8,10-14,18H,2-5,7,9H2,1H3,(H,20,21)