2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid

Systemtic Name: 2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid Openeye Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methyl]allyloxymethylphosphonic acid CAS Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid IUPAC Name: 2-[(2-amino-6-oxo-3H-purin-9-yl)methyl]prop-2-enoxymethylphosphonic acid Traditional Name: 2-[(2-amino-6-keto-3H-purin-9-yl)methyl]allyloxymethylphosphonic acid Formula: C10H14N5O5P MolecularWeight: 315.222421

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1C=NC2=C1NC(=NC2=O)N)COCP(=O)(O)O

Isomeric SMILES

C=C(CN1C=NC2=C1NC(=NC2=O)N)COCP(=O)(O)O

InChI

InChI=1S/C10H14N5O5P/c1-6(3-20-5-21(17,18)19)2-15-4-12-7-8(15)13-10(11)14-9(7)16/h4H,1-3,5H2,(H2,17,18,19)(H3,11,13,14,16)