2-[4-(4-chlorophenyl)phenyl]sulfonyloctanoic acid

Systemtic Name: 2-[4-(4-chlorophenyl)phenyl]sulfonyloctanoic acid Openeye Name: 2-[4-(4-chlorophenyl)phenyl]sulfonyloctanoic acid CAS Name: 2-[4-(4-chlorophenyl)phenyl]sulfonyloctanoic acid IUPAC Name: 2-[4-(4-chlorophenyl)phenyl]sulfonyloctanoic acid Traditional Name: 2-[4-(4-chlorophenyl)phenyl]sulfonylcaprylic acid Formula: C20H23ClO4S MolecularWeight: 394.91222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCC(C(=O)O)S(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H23ClO4S/c1-2-3-4-5-6-19(20(22)23)26(24,25)18-13-9-16(10-14-18)15-7-11-17(21)12-8-15/h7-14,19H,2-6H2,1H3,(H,22,23)