1-(2-ethyl-2-methyl-1,3-benzoxathiol-5-yl)ethanone

Systemtic Name: 1-(2-ethyl-2-methyl-1,3-benzoxathiol-5-yl)ethanone Openeye Name: 1-(2-ethyl-2-methyl-1,3-benzoxathiol-5-yl)ethanone CAS Name: 1-(2-ethyl-2-methyl-1,3-benzoxathiol-5-yl)ethanone IUPAC Name: 1-(2-ethyl-2-methyl-1,3-benzoxathiol-5-yl)ethanone Traditional Name: 1-(2-ethyl-2-methyl-1,3-benzoxathiol-5-yl)ethanone Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(OC2=C(S1)C=C(C=C2)C(=O)C)C

Isomeric SMILES

CCC1(OC2=C(S1)C=C(C=C2)C(=O)C)C

InChI

InChI=1S/C12H14O2S/c1-4-12(3)14-10-6-5-9(8(2)13)7-11(10)15-12/h5-7H,4H2,1-3H3