dimethyl phosphate; 1-methyl-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium

Systemtic Name: dimethyl phosphate; 1-methyl-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium Openeye Name: dimethyl phosphate; 1-methyl-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium CAS Name: dimethyl phosphate; 1-methyl-4-(1-methyl-4-pyridin-1-iumyl)pyridin-1-ium IUPAC Name: dimethyl phosphate; 1-methyl-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium Traditional Name: dimethyl phosphate; 1-methyl-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium Formula: C14H20N2O4P+ MolecularWeight: 311.293361

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C.COP(=O)([O-])OC

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=CC=[N+](C=C2)C.COP(=O)([O-])OC

InChI

InChI=1S/C12H14N2.C2H7O4P/c1-13-7-3-11(4-8-13)12-5-9-14(2)10-6-12;1-5-7(3,4)6-2/h3-10H,1-2H3;1-2H3,(H,3,4)/q+2;/p-1