(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)phosphonic acid; 1-methoxypropane

Systemtic Name: (2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)phosphonic acid; 1-methoxypropane Openeye Name: (2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)phosphonic acid; 1-methoxypropane CAS Name: (2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)phosphonic acid; 1-methoxypropane IUPAC Name: (2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)phosphonic acid; 1-methoxypropane Traditional Name: (2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)phosphonic acid; 1-methoxypropane Formula: C9H18N5O5P MolecularWeight: 307.243481

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC.C1NC2=C(N1P(=O)(O)O)NC(=NC2=O)N

Isomeric SMILES

CCCOC.C1NC2=C(N1P(=O)(O)O)NC(=NC2=O)N

InChI

InChI=1S/C5H8N5O4P.C4H10O/c6-5-8-3-2(4(11)9-5)7-1-10(3)15(12,13)14;1-3-4-5-2/h7H,1H2,(H2,12,13,14)(H3,6,8,9,11);3-4H2,1-2H3