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

Systemtic Name: 7-(4-chlorophenyl)-2-(4-methoxyphenyl)sulfanyl-heptanoic acid Openeye Name: 7-(4-chlorophenyl)-2-(4-methoxyphenyl)sulfanyl-heptanoic acid CAS Name: 7-(4-chlorophenyl)-2-[(4-methoxyphenyl)thio]heptanoic acid IUPAC Name: 7-(4-chlorophenyl)-2-(4-methoxyphenyl)sulfanylheptanoic acid Traditional Name: 7-(4-chlorophenyl)-2-[(4-methoxyphenyl)thio]enanthic acid Formula: C20H23ClO3S MolecularWeight: 378.91282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClO3S/c1-24-17-11-13-18(14-12-17)25-19(20(22)23)6-4-2-3-5-15-7-9-16(21)10-8-15/h7-14,19H,2-6H2,1H3,(H,22,23)