2-(4-methoxyphenyl)sulfanyl-7-phenyl-heptanoic acid

Systemtic Name: 2-(4-methoxyphenyl)sulfanyl-7-phenyl-heptanoic acid Openeye Name: 2-(4-methoxyphenyl)sulfanyl-7-phenyl-heptanoic acid CAS Name: 2-[(4-methoxyphenyl)thio]-7-phenylheptanoic acid IUPAC Name: 2-(4-methoxyphenyl)sulfanyl-7-phenylheptanoic acid Traditional Name: 2-[(4-methoxyphenyl)thio]-7-phenyl-enanthic acid Formula: C20H24O3S MolecularWeight: 344.46776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC(CCCCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)SC(CCCCCC2=CC=CC=C2)C(=O)O

InChI

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