2-([1]benzofuro[3,2-d]pyrimidin-4-ylazaniumyl)ethyl-dimethyl-azanium dichloride

Systemtic Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylazaniumyl)ethyl-dimethyl-azanium dichloride Openeye Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylammonio)ethyl-dimethyl-ammonium dichloride CAS Name: 2-(4-benzofuro[3,2-d]pyrimidinylammonio)ethyl-dimethylammonium dichloride IUPAC Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylazaniumyl)ethyl-dimethylazanium dichloride Traditional Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylammonio)ethyl-dimethyl-ammonium dichloride Formula: C14H18Cl2N4O MolecularWeight: 329.22492

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH2+]C1=NC=NC2=C1OC3=CC=CC=C32.[Cl-].[Cl-]

Isomeric SMILES

C[NH+](C)CC[NH2+]C1=NC=NC2=C1OC3=CC=CC=C32.[Cl-].[Cl-]

InChI

InChI=1S/C14H16N4O.2ClH/c1-18(2)8-7-15-14-13-12(16-9-17-14)10-5-3-4-6-11(10)19-13;;/h3-6,9H,7-8H2,1-2H3,(H,15,16,17);2*1H