N-methylpyrimidin-2-amine; oxidanyl-oxidanylidene-(phosphonomethyl)phosphanium

Systemtic Name: N-methylpyrimidin-2-amine; oxidanyl-oxidanylidene-(phosphonomethyl)phosphanium Openeye Name: hydroxy-oxo-(phosphonomethyl)phosphonium; N-methylpyrimidin-2-amine CAS Name: hydroxy-oxo-(phosphonomethyl)phosphonium; N-methyl-2-pyrimidinamine IUPAC Name: hydroxy-oxo-(phosphonomethyl)phosphanium; N-methylpyrimidin-2-amine Traditional Name: hydroxy-keto-(phosphonomethyl)phosphonium; methyl(2-pyrimidyl)amine Formula: C6H12N3O5P2+ MolecularWeight: 268.124102

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=CC=N1.C([P+](=O)O)P(=O)(O)O

Isomeric SMILES

CNC1=NC=CC=N1.C([P+](=O)O)P(=O)(O)O

InChI

InChI=1S/C5H7N3.CH4O5P2/c1-6-5-7-3-2-4-8-5;2-7(3)1-8(4,5)6/h2-4H,1H3,(H,6,7,8);1H2,(H2-,2,3,4,5,6)/p+1