[(1E)-buta-1,3-dienyl]-methoxycarbonyl-azanium dichloride

Systemtic Name: [(1E)-buta-1,3-dienyl]-methoxycarbonyl-azanium dichloride Openeye Name: [(1E)-buta-1,3-dienyl]-methoxycarbonyl-ammonium dichloride CAS Name: [(1E)-buta-1,3-dienyl]-methoxycarbonylammonium dichloride IUPAC Name: [(1E)-buta-1,3-dienyl]-methoxycarbonylazanium dichloride Traditional Name: [(1E)-buta-1,3-dienyl]-carbomethoxy-ammonium dichloride Formula: C6H10Cl2NO2- MolecularWeight: 199.0551

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)[NH2+]C=CC=C.[Cl-].[Cl-]

Isomeric SMILES

COC(=O)[NH2+]/C=C/C=C.[Cl-].[Cl-]

InChI

InChI=1S/C6H9NO2.2ClH/c1-3-4-5-7-6(8)9-2;;/h3-5H,1H2,2H3,(H,7,8);2*1H/p-1/b5-4+;;