(7-azanyl-5-oxidanylidene-4,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl phosphono hydrogen phosphate

Systemtic Name: (7-azanyl-5-oxidanylidene-4,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl phosphono hydrogen phosphate Openeye Name: (7-amino-5-oxo-4,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl phosphono hydrogen phosphate CAS Name: (7-amino-5-oxo-4,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl phosphono hydrogen phosphate IUPAC Name: (7-amino-5-oxo-4,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl phosphono hydrogen phosphate Traditional Name: (7-amino-5-keto-4,6-dihydro-1H-pyrido[3,4-b]pyrazin-3-yl)methyl phosphono hydrogen phosphate Formula: C8H12N4O8P2 MolecularWeight: 354.150402

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=O)C2=C1NC=C(N2)COP(=O)(O)OP(=O)(O)O)N

Isomeric SMILES

C1=C(NC(=O)C2=C1NC=C(N2)COP(=O)(O)OP(=O)(O)O)N

InChI

InChI=1S/C8H12N4O8P2/c9-6-1-5-7(8(13)12-6)11-4(2-10-5)3-19-22(17,18)20-21(14,15)16/h1-2,10-11H,3H2,(H,17,18)(H3,9,12,13)(H2,14,15,16)