3-[(4-methoxyphenyl)sulfanylmethyl]-6-phenyl-hexanoic acid

Systemtic Name: 3-[(4-methoxyphenyl)sulfanylmethyl]-6-phenyl-hexanoic acid Openeye Name: 3-[(4-methoxyphenyl)sulfanylmethyl]-6-phenyl-hexanoic acid CAS Name: 3-[[(4-methoxyphenyl)thio]methyl]-6-phenylhexanoic acid IUPAC Name: 3-[(4-methoxyphenyl)sulfanylmethyl]-6-phenylhexanoic acid Traditional Name: 3-[[(4-methoxyphenyl)thio]methyl]-6-phenyl-hexanoic acid Formula: C20H24O3S MolecularWeight: 344.46776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24O3S/c1-23-18-10-12-19(13-11-18)24-15-17(14-20(21)22)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-13,17H,5,8-9,14-15H2,1H3,(H,21,22)