9-methyl-9-(phenylsulfanylmethyl)-7,10,11-trioxaspiro[5.5]undecan-3-one

Systemtic Name: 9-methyl-9-(phenylsulfanylmethyl)-7,10,11-trioxaspiro[5.5]undecan-3-one Openeye Name: 9-methyl-9-(phenylsulfanylmethyl)-7,10,11-trioxaspiro[5.5]undecan-3-one CAS Name: 9-methyl-9-[(phenylthio)methyl]-7,10,11-trioxaspiro[5.5]undecan-3-one IUPAC Name: 9-methyl-9-(phenylsulfanylmethyl)-7,10,11-trioxaspiro[5.5]undecan-3-one Traditional Name: 9-methyl-9-[(phenylthio)methyl]-7,10,11-trioxaspiro[5.5]undecan-3-one Formula: C16H20O4S MolecularWeight: 308.3926

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2(CCC(=O)CC2)OO1)CSC3=CC=CC=C3

Isomeric SMILES

CC1(COC2(CCC(=O)CC2)OO1)CSC3=CC=CC=C3

InChI

InChI=1S/C16H20O4S/c1-15(12-21-14-5-3-2-4-6-14)11-18-16(20-19-15)9-7-13(17)8-10-16/h2-6H,7-12H2,1H3