spiro[3,1-benzoxathiine-2,1'-cyclohexane]-4-one

Systemtic Name: spiro[3,1-benzoxathiine-2,1'-cyclohexane]-4-one Openeye Name: spiro[3,1-benzoxathiine-2,1'-cyclohexane]-4-one CAS Name: 4-spiro[3,1-benzoxathiin-2,1'-cyclohexane]one IUPAC Name: spiro[3,1-benzoxathiine-2,1'-cyclohexane]-4-one Traditional Name: spiro[3,1-benzoxathiin-2,1'-cyclohexane]-4-one Formula: C13H14O2S MolecularWeight: 234.31406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC(=O)C3=CC=CC=C3S2

Isomeric SMILES

C1CCC2(CC1)OC(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C13H14O2S/c14-12-10-6-2-3-7-11(10)16-13(15-12)8-4-1-5-9-13/h2-3,6-7H,1,4-5,8-9H2