[3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)prop-1-en-2-yloxy-[oxidanyl(oxidanylidene)phosphaniumyl]oxy-phosphonoperoxy-methyl]-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: [3-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)prop-1-en-2-yloxy-[oxidanyl(oxidanylidene)phosphaniumyl]oxy-phosphonoperoxy-methyl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [1-[(2-amino-6-oxo-3H-purin-9-yl)methyl]vinyloxy-[hydroxy(oxo)phosphaniumyl]oxy-phosphonoperoxy-methyl]-hydroxy-oxo-phosphonium CAS Name: [3-(2-amino-6-oxo-3H-purin-9-yl)prop-1-en-2-yloxy-[hydroxy(oxo)phosphiniumyl]oxy-phosphonodioxymethyl]-hydroxy-oxophosphonium IUPAC Name: [3-(2-amino-6-oxo-3H-purin-9-yl)prop-1-en-2-yloxy-[hydroxy(oxo)phosphaniumyl]oxy-phosphonoperoxymethyl]-hydroxy-oxophosphanium Traditional Name: [1-[(2-amino-6-keto-3H-purin-9-yl)methyl]vinyloxy-[hydroxy(keto)phosphiniumyl]oxy-phosphonoperoxy-methyl]-hydroxy-keto-phosphonium Formula: C9H12N5O12P3+2 MolecularWeight: 475.139163

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN1C=NC2=C1NC(=NC2=O)N)OC(OOP(=O)(O)O)(O[P+](=O)O)[P+](=O)O

Isomeric SMILES

C=C(CN1C=NC2=C1NC(=NC2=O)N)OC(OOP(=O)(O)O)(O[P+](=O)O)[P+](=O)O

InChI

InChI=1S/C9H9N5O12P3/c1-4(2-14-3-11-5-6(14)12-8(10)13-7(5)15)23-9(27(16)17,25-28(18)19)24-26-29(20,21)22/h3H,1-2H2,(H4-3,10,12,13,15,16,17,18,19,20,21,22)/q-1/p+3