S-ethyl 2-methyl-4-oxidanyl-4-[(E)-5-phenylpent-2-en-2-yl]-3,6-dioxabicyclo[3.1.0]hexane-5-carbothioate

Systemtic Name: S-ethyl 2-methyl-4-oxidanyl-4-[(E)-5-phenylpent-2-en-2-yl]-3,6-dioxabicyclo[3.1.0]hexane-5-carbothioate Openeye Name: S-ethyl 4-hydroxy-2-methyl-4-[(E)-1-methyl-4-phenyl-but-1-enyl]-3,6-dioxabicyclo[3.1.0]hexane-5-carbothioate CAS Name: 4-hydroxy-2-methyl-4-[(E)-5-phenylpent-2-en-2-yl]-3,6-dioxabicyclo[3.1.0]hexane-5-carbothioic acid S-ethyl ester IUPAC Name: S-ethyl 4-hydroxy-2-methyl-4-[(E)-5-phenylpent-2-en-2-yl]-3,6-dioxabicyclo[3.1.0]hexane-5-carbothioate Traditional Name: 4-hydroxy-2-methyl-4-[(E)-1-methyl-4-phenyl-but-1-enyl]-3,6-dioxabicyclo[3.1.0]hexane-5-carbothioic acid S-ethyl ester Formula: C19H24O4S MolecularWeight: 348.45646

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C12C(O1)C(OC2(C(=CCCC3=CC=CC=C3)C)O)C

Isomeric SMILES

CCSC(=O)C12C(O1)C(OC2(/C(=C/CCC3=CC=CC=C3)/C)O)C

InChI

InChI=1S/C19H24O4S/c1-4-24-17(20)18-16(23-18)14(3)22-19(18,21)13(2)9-8-12-15-10-6-5-7-11-15/h5-7,9-11,14,16,21H,4,8,12H2,1-3H3/b13-9+