ethane; [(E)-2-methyl-7-oxidanylidene-hept-3-en-2-yl] propanedithioate; tungsten(2+)

Systemtic Name: ethane; [(E)-2-methyl-7-oxidanylidene-hept-3-en-2-yl] propanedithioate; tungsten(2+) Openeye Name: [(E)-1,1-dimethyl-6-oxo-hex-2-enyl] propanedithioate; ethane; tungsten(2+) CAS Name: ethane; propanedithioic acid [(E)-2-methyl-7-oxohept-3-en-2-yl] ester; tungsten(2+) IUPAC Name: ethane; [(E)-2-methyl-7-oxohept-3-en-2-yl] propanedithioate; tungsten(2+) Traditional Name: ethane; propanedithioic acid [(E)-6-keto-1,1-dimethyl-hex-2-enyl] ester; tungsten(2+) Formula: C13H22OS2W MolecularWeight: 442.28318

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Descriptors Computed from Structure

Canonical SMILES:

C[CH2-].CCC(=S)SC(C)(C)C=CCC[C-]=O.[W+2]

Isomeric SMILES

C[CH2-].CCC(=S)SC(C)(C)/C=C/CC[C-]=O.[W+2]

InChI

InChI=1S/C11H17OS2.C2H5.W/c1-4-10(13)14-11(2,3)8-6-5-7-9-12;1-2;/h6,8H,4-5,7H2,1-3H3;1H2,2H3;/q2*-1;+2/b8-6+;;