(1S,4R,5R,6R)-3-bromanyl-6-phenylsulfanyl-bicyclo[3.1.1]hept-2-en-4-ol

Systemtic Name: (1S,4R,5R,6R)-3-bromanyl-6-phenylsulfanyl-bicyclo[3.1.1]hept-2-en-4-ol Openeye Name: (1S,4R,5R,6R)-3-bromo-6-phenylsulfanyl-bicyclo[3.1.1]hept-2-en-4-ol CAS Name: (1S,4R,5R,6R)-3-bromo-6-(phenylthio)-4-bicyclo[3.1.1]hept-2-enol IUPAC Name: (1S,4R,5R,6R)-3-bromo-6-phenylsulfanylbicyclo[3.1.1]hept-2-en-4-ol Traditional Name: (1S,4R,5R,6R)-3-bromo-6-(phenylthio)bicyclo[3.1.1]hept-2-en-4-ol Formula: C13H13BrOS MolecularWeight: 297.21072

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=C(C(C1C2SC3=CC=CC=C3)O)Br

Isomeric SMILES

C1[C@H]2C=C([C@@H]([C@@H]1[C@@H]2SC3=CC=CC=C3)O)Br

InChI

InChI=1S/C13H13BrOS/c14-11-7-8-6-10(12(11)15)13(8)16-9-4-2-1-3-5-9/h1-5,7-8,10,12-13,15H,6H2/t8-,10+,12+,13+/m0/s1