(4,5,6,7-tetradeuterio-1-iodanyl-heptan-2-yl) methylsulfanylmethanoate

Systemtic Name: (4,5,6,7-tetradeuterio-1-iodanyl-heptan-2-yl) methylsulfanylmethanoate Openeye Name: [3,4,5,6-tetradeuterio-1-(iodomethyl)hexyl] methylsulfanylformate CAS Name: (methylthio)formic acid (4,5,6,7-tetradeuterio-1-iodoheptan-2-yl) ester IUPAC Name: (4,5,6,7-tetradeuterio-1-iodoheptan-2-yl) methylsulfanylformate Traditional Name: (methylthio)formic acid [3,4,5,6-tetradeuterio-1-(iodomethyl)hexyl] ester Formula: C9H17IO2S MolecularWeight: 320.224197

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CI)OC(=O)SC

Isomeric SMILES

[2H]CC([2H])C([2H])C([2H])CC(CI)OC(=O)SC

InChI

InChI=1S/C9H17IO2S/c1-3-4-5-6-8(7-10)12-9(11)13-2/h8H,3-7H2,1-2H3/i1D,3D,4D,5D