1-spiro[1,3-benzoxathiole-2,1'-cyclopentane]-5-ylethanone

Systemtic Name: 1-spiro[1,3-benzoxathiole-2,1'-cyclopentane]-5-ylethanone Openeye Name: 1-spiro[1,3-benzoxathiole-2,1'-cyclopentane]-5-ylethanone CAS Name: 1-(5-spiro[1,3-benzoxathiole-2,1'-cyclopentane]yl)ethanone IUPAC Name: 1-spiro[1,3-benzoxathiole-2,1'-cyclopentane]-5-ylethanone Traditional Name: 1-spiro[1,3-benzoxathiole-2,1'-cyclopentane]-5-ylethanone Formula: C13H14O2S MolecularWeight: 234.31406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC3(S2)CCCC3

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC3(S2)CCCC3

InChI

InChI=1S/C13H14O2S/c1-9(14)10-4-5-11-12(8-10)16-13(15-11)6-2-3-7-13/h4-5,8H,2-3,6-7H2,1H3