3-methyl-2-[3-(4-phenylcyclohexyl)oxypropylsulfanylmethyl]butanoic acid

Systemtic Name: 3-methyl-2-[3-(4-phenylcyclohexyl)oxypropylsulfanylmethyl]butanoic acid Openeye Name: 3-methyl-2-[3-(4-phenylcyclohexoxy)propylsulfanylmethyl]butanoic acid CAS Name: 3-methyl-2-[[3-(4-phenylcyclohexyl)oxypropylthio]methyl]butanoic acid IUPAC Name: 3-methyl-2-[3-(4-phenylcyclohexyl)oxypropylsulfanylmethyl]butanoic acid Traditional Name: 3-methyl-2-[[3-(4-phenylcyclohexoxy)propylthio]methyl]butyric acid Formula: C21H32O3S MolecularWeight: 364.54198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CSCCCOC1CCC(CC1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)C(CSCCCOC1CCC(CC1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C21H32O3S/c1-16(2)20(21(22)23)15-25-14-6-13-24-19-11-9-18(10-12-19)17-7-4-3-5-8-17/h3-5,7-8,16,18-20H,6,9-15H2,1-2H3,(H,22,23)