3-(2-prop-2-ynylsulfanylpropan-2-yl)-1,2,4,5-tetraoxepane

Systemtic Name: 3-(2-prop-2-ynylsulfanylpropan-2-yl)-1,2,4,5-tetraoxepane Openeye Name: 3-(1-methyl-1-prop-2-ynylsulfanyl-ethyl)-1,2,4,5-tetraoxepane CAS Name: 3-[2-(prop-2-ynylthio)propan-2-yl]-1,2,4,5-tetraoxepane IUPAC Name: 3-(2-prop-2-ynylsulfanylpropan-2-yl)-1,2,4,5-tetraoxepane Traditional Name: 3-[1-methyl-1-(propargylthio)ethyl]-1,2,4,5-tetraoxepane Formula: C9H14O4S MolecularWeight: 218.27006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1OOCCOO1)SCC#C

Isomeric SMILES

CC(C)(C1OOCCOO1)SCC#C

InChI

InChI=1S/C9H14O4S/c1-4-7-14-9(2,3)8-12-10-5-6-11-13-8/h1,8H,5-7H2,2-3H3