4-[2-(4-chlorophenyl)ethoxy]-2-hexylsulfanyl-butanoic acid

Systemtic Name: 4-[2-(4-chlorophenyl)ethoxy]-2-hexylsulfanyl-butanoic acid Openeye Name: 4-[2-(4-chlorophenyl)ethoxy]-2-hexylsulfanyl-butanoic acid CAS Name: 4-[2-(4-chlorophenyl)ethoxy]-2-(hexylthio)butanoic acid IUPAC Name: 4-[2-(4-chlorophenyl)ethoxy]-2-hexylsulfanylbutanoic acid Traditional Name: 4-[2-(4-chlorophenyl)ethoxy]-2-(hexylthio)butyric acid Formula: C18H27ClO3S MolecularWeight: 358.92318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(CCOCCC1=CC=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CCCCCCSC(CCOCCC1=CC=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C18H27ClO3S/c1-2-3-4-5-14-23-17(18(20)21)11-13-22-12-10-15-6-8-16(19)9-7-15/h6-9,17H,2-5,10-14H2,1H3,(H,20,21)