6-[(2R,3S)-3-tert-butylsulfanyl-2-oxidanyl-4-phenyl-butyl]-2,2-dimethyl-1,3-dioxin-4-one

Systemtic Name: 6-[(2R,3S)-3-tert-butylsulfanyl-2-oxidanyl-4-phenyl-butyl]-2,2-dimethyl-1,3-dioxin-4-one Openeye Name: 6-[(2R,3S)-3-tert-butylsulfanyl-2-hydroxy-4-phenyl-butyl]-2,2-dimethyl-1,3-dioxin-4-one CAS Name: 6-[(2R,3S)-3-(tert-butylthio)-2-hydroxy-4-phenylbutyl]-2,2-dimethyl-1,3-dioxin-4-one IUPAC Name: 6-[(2R,3S)-3-tert-butylsulfanyl-2-hydroxy-4-phenylbutyl]-2,2-dimethyl-1,3-dioxin-4-one Traditional Name: 6-[(2R,3S)-3-(tert-butylthio)-2-hydroxy-4-phenyl-butyl]-2,2-dimethyl-1,3-dioxin-4-one Formula: C20H28O4S MolecularWeight: 364.49892

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=CC(=O)O1)CC(C(CC2=CC=CC=C2)SC(C)(C)C)O)C

Isomeric SMILES

CC1(OC(=CC(=O)O1)C[C@H]([C@H](CC2=CC=CC=C2)SC(C)(C)C)O)C

InChI

InChI=1S/C20H28O4S/c1-19(2,3)25-17(11-14-9-7-6-8-10-14)16(21)12-15-13-18(22)24-20(4,5)23-15/h6-10,13,16-17,21H,11-12H2,1-5H3/t16-,17+/m1/s1