3-[(4-chlorophenyl)sulfanylmethyl]-3-methyl-1,4,5-trioxaspiro[5.11]heptadecane

Systemtic Name: 3-[(4-chlorophenyl)sulfanylmethyl]-3-methyl-1,4,5-trioxaspiro[5.11]heptadecane Openeye Name: 3-[(4-chlorophenyl)sulfanylmethyl]-3-methyl-1,4,5-trioxaspiro[5.11]heptadecane CAS Name: 3-[[(4-chlorophenyl)thio]methyl]-3-methyl-1,4,5-trioxaspiro[5.11]heptadecane IUPAC Name: 3-[(4-chlorophenyl)sulfanylmethyl]-3-methyl-1,4,5-trioxaspiro[5.11]heptadecane Traditional Name: 3-[[(4-chlorophenyl)thio]methyl]-3-methyl-1,4,5-trioxaspiro[5.11]heptadecane Formula: C22H33ClO3S MolecularWeight: 413.01362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2(CCCCCCCCCCC2)OO1)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1(COC2(CCCCCCCCCCC2)OO1)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H33ClO3S/c1-21(18-27-20-13-11-19(23)12-14-20)17-24-22(26-25-21)15-9-7-5-3-2-4-6-8-10-16-22/h11-14H,2-10,15-18H2,1H3