(4R,5aR)-9-butyl-4-oxidanyl-5,5a,6,7-tetrahydro-4H-benzo[e][1]benzothiol-8-one

Systemtic Name: (4R,5aR)-9-butyl-4-oxidanyl-5,5a,6,7-tetrahydro-4H-benzo[e][1]benzothiol-8-one Openeye Name: (4R,5aR)-9-butyl-4-hydroxy-5,5a,6,7-tetrahydro-4H-benzo[e]benzothiophen-8-one CAS Name: (4R,5aR)-9-butyl-4-hydroxy-5,5a,6,7-tetrahydro-4H-benzo[e][1]benzothiol-8-one IUPAC Name: (4R,5aR)-9-butyl-4-hydroxy-5,5a,6,7-tetrahydro-4H-benzo[e][1]benzothiol-8-one Traditional Name: (4R,5aR)-9-butyl-4-hydroxy-5,5a,6,7-tetrahydro-4H-benzo[e]benzothiophen-8-one Formula: C16H20O2S MolecularWeight: 276.3938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(CCC1=O)CC(C3=C2C=CS3)O

Isomeric SMILES

CCCCC1=C2[C@H](CCC1=O)C[C@H](C3=C2C=CS3)O

InChI

InChI=1S/C16H20O2S/c1-2-3-4-11-13(17)6-5-10-9-14(18)16-12(15(10)11)7-8-19-16/h7-8,10,14,18H,2-6,9H2,1H3/t10-,14-/m1/s1