(3R,4S,5S)-4-methyl-4-oxidanyl-3-(phenylsulfanylmethyl)-8-oxaspiro[4.4]nonan-9-one

Systemtic Name: (3R,4S,5S)-4-methyl-4-oxidanyl-3-(phenylsulfanylmethyl)-8-oxaspiro[4.4]nonan-9-one Openeye Name: (3R,4S,5S)-4-hydroxy-4-methyl-3-(phenylsulfanylmethyl)-8-oxaspiro[4.4]nonan-9-one CAS Name: (3R,4S,5S)-4-hydroxy-4-methyl-3-[(phenylthio)methyl]-8-oxaspiro[4.4]nonan-9-one IUPAC Name: (3R,4S,5S)-4-hydroxy-4-methyl-3-(phenylsulfanylmethyl)-8-oxaspiro[4.4]nonan-9-one Traditional Name: (3R,4S,5S)-4-hydroxy-4-methyl-3-[(phenylthio)methyl]-8-oxaspiro[4.4]nonan-9-one Formula: C16H20O3S MolecularWeight: 292.3932

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC12CCOC2=O)CSC3=CC=CC=C3)O

Isomeric SMILES

C[C@@]1([C@@H](CC[C@]12CCOC2=O)CSC3=CC=CC=C3)O

InChI

InChI=1S/C16H20O3S/c1-15(18)12(11-20-13-5-3-2-4-6-13)7-8-16(15)9-10-19-14(16)17/h2-6,12,18H,7-11H2,1H3/t12-,15-,16+/m0/s1