1,3-dithiol-2-ylidene-(1-ethoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)-methyl-azanium

Systemtic Name: 1,3-dithiol-2-ylidene-(1-ethoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)-methyl-azanium Openeye Name: 1,3-dithiol-2-ylidene-(1-ethoxycarbonyl-3-methylsulfanyl-propyl)-methyl-ammonium CAS Name: 1,3-dithiol-2-ylidene-[1-ethoxy-4-(methylthio)-1-oxobutan-2-yl]-methylammonium IUPAC Name: 1,3-dithiol-2-ylidene-(1-ethoxy-4-methylsulfanyl-1-oxobutan-2-yl)-methylazanium Traditional Name: [1-carbethoxy-3-(methylthio)propyl]-(1,3-dithiol-2-ylidene)-methyl-ammonium Formula: C11H18NO2S3+ MolecularWeight: 292.46112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)[N+](=C1SC=CS1)C

Isomeric SMILES

CCOC(=O)C(CCSC)[N+](=C1SC=CS1)C

InChI

InChI=1S/C11H18NO2S3/c1-4-14-10(13)9(5-6-15-3)12(2)11-16-7-8-17-11/h7-9H,4-6H2,1-3H3/q+1