8-(2-chlorophenyl)sulfanyloctanoic acid

Systemtic Name: 8-(2-chlorophenyl)sulfanyloctanoic acid Openeye Name: 8-(2-chlorophenyl)sulfanyloctanoic acid CAS Name: 8-[(2-chlorophenyl)thio]octanoic acid IUPAC Name: 8-(2-chlorophenyl)sulfanyloctanoic acid Traditional Name: 8-[(2-chlorophenyl)thio]caprylic acid Formula: C14H19ClO2S MolecularWeight: 286.81746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SCCCCCCCC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)SCCCCCCCC(=O)O)Cl

InChI

InChI=1S/C14H19ClO2S/c15-12-8-5-6-9-13(12)18-11-7-3-1-2-4-10-14(16)17/h5-6,8-9H,1-4,7,10-11H2,(H,16,17)