1-[(4-chlorophenyl)methylsulfanylmethyl]-3-methoxy-2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]cyclohexane-1,4-diol

Systemtic Name: 1-[(4-chlorophenyl)methylsulfanylmethyl]-3-methoxy-2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]cyclohexane-1,4-diol Openeye Name: 1-[(4-chlorophenyl)methylsulfanylmethyl]-3-methoxy-2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]cyclohexane-1,4-diol CAS Name: 1-[[(4-chlorophenyl)methylthio]methyl]-3-methoxy-2-[2-methyl-3-(3-methylbut-2-enyl)-2-oxiranyl]cyclohexane-1,4-diol IUPAC Name: 1-[(4-chlorophenyl)methylsulfanylmethyl]-3-methoxy-2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]cyclohexane-1,4-diol Traditional Name: 1-[[(4-chlorobenzyl)thio]methyl]-3-methoxy-2-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]cyclohexane-1,4-diol Formula: C23H33ClO4S MolecularWeight: 441.02372

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1C(O1)(C)C2C(C(CCC2(CSCC3=CC=C(C=C3)Cl)O)O)OC)C

Isomeric SMILES

CC(=CCC1C(O1)(C)C2C(C(CCC2(CSCC3=CC=C(C=C3)Cl)O)O)OC)C

InChI

InChI=1S/C23H33ClO4S/c1-15(2)5-10-19-22(3,28-19)21-20(27-4)18(25)11-12-23(21,26)14-29-13-16-6-8-17(24)9-7-16/h5-9,18-21,25-26H,10-14H2,1-4H3