3-(4-methoxyphenyl)sulfanyl-6-phenyl-hexanoic acid

Systemtic Name: 3-(4-methoxyphenyl)sulfanyl-6-phenyl-hexanoic acid Openeye Name: 3-(4-methoxyphenyl)sulfanyl-6-phenyl-hexanoic acid CAS Name: 3-[(4-methoxyphenyl)thio]-6-phenylhexanoic acid IUPAC Name: 3-(4-methoxyphenyl)sulfanyl-6-phenylhexanoic acid Traditional Name: 3-[(4-methoxyphenyl)thio]-6-phenyl-hexanoic acid Formula: C19H22O3S MolecularWeight: 330.44118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC(CCCC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)SC(CCCC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C19H22O3S/c1-22-16-10-12-17(13-11-16)23-18(14-19(20)21)9-5-8-15-6-3-2-4-7-15/h2-4,6-7,10-13,18H,5,8-9,14H2,1H3,(H,20,21)