[2-[3-(dimethylamino)pyrazin-1-ium-1-yl]-1-phosphono-ethyl]phosphonic acid

Systemtic Name: [2-[3-(dimethylamino)pyrazin-1-ium-1-yl]-1-phosphono-ethyl]phosphonic acid Openeye Name: [2-[3-(dimethylamino)pyrazin-1-ium-1-yl]-1-phosphono-ethyl]phosphonic acid CAS Name: [2-[3-(dimethylamino)-1-pyrazin-1-iumyl]-1-phosphonoethyl]phosphonic acid IUPAC Name: [2-[3-(dimethylamino)pyrazin-1-ium-1-yl]-1-phosphonoethyl]phosphonic acid Traditional Name: [2-[3-(dimethylamino)pyrazin-1-ium-1-yl]-1-phosphono-ethyl]phosphonic acid Formula: C8H16N3O6P2+ MolecularWeight: 312.176662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C[N+](=C1)CC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CN(C)C1=NC=C[N+](=C1)CC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C8H15N3O6P2/c1-10(2)7-5-11(4-3-9-7)6-8(18(12,13)14)19(15,16)17/h3-5,8H,6H2,1-2H3,(H3-,12,13,14,15,16,17)/p+1