6-[4-(phenylmethyl)phenyl]sulfanylhexanoic acid

Systemtic Name: 6-[4-(phenylmethyl)phenyl]sulfanylhexanoic acid Openeye Name: 6-(4-benzylphenyl)sulfanylhexanoic acid CAS Name: 6-[[4-(phenylmethyl)phenyl]thio]hexanoic acid IUPAC Name: 6-(4-benzylphenyl)sulfanylhexanoic acid Traditional Name: 6-[(4-benzylphenyl)thio]hexanoic acid Formula: C19H22O2S MolecularWeight: 314.44178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=C(C=C2)SCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=C(C=C2)SCCCCCC(=O)O

InChI

InChI=1S/C19H22O2S/c20-19(21)9-5-2-6-14-22-18-12-10-17(11-13-18)15-16-7-3-1-4-8-16/h1,3-4,7-8,10-13H,2,5-6,9,14-15H2,(H,20,21)