phenyl-[(1S,2S,4R)-3-thiabicyclo[2.2.1]hept-5-en-2-yl]methanone

Systemtic Name: phenyl-[(1S,2S,4R)-3-thiabicyclo[2.2.1]hept-5-en-2-yl]methanone Openeye Name: phenyl-[(1S,2S,4R)-3-thiabicyclo[2.2.1]hept-5-en-2-yl]methanone CAS Name: phenyl-[(1S,2S,4R)-3-thiabicyclo[2.2.1]hept-5-en-2-yl]methanone IUPAC Name: phenyl-[(1S,2S,4R)-3-thiabicyclo[2.2.1]hept-5-en-2-yl]methanone Traditional Name: phenyl-[(1S,2S,4R)-3-thiabicyclo[2.2.1]hept-5-en-2-yl]methanone Formula: C13H12OS MolecularWeight: 216.29878

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC1SC2C(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C13H12OS/c14-12(9-4-2-1-3-5-9)13-10-6-7-11(8-10)15-13/h1-7,10-11,13H,8H2/t10-,11+,13+/m1/s1