[[4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)cyclopent-2-en-1-yl]oxy-[bis(fluoranyl)-phosphono-methoxy]-[oxidanyl(oxidanylidene)phosphaniumyl]methoxy]-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: [[4-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)cyclopent-2-en-1-yl]oxy-[bis(fluoranyl)-phosphono-methoxy]-[oxidanyl(oxidanylidene)phosphaniumyl]methoxy]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [[4-(2-amino-6-oxo-3H-purin-9-yl)cyclopent-2-en-1-yl]oxy-[difluoro(phosphono)methoxy]-[hydroxy(oxo)phosphaniumyl]methoxy]-hydroxy-oxo-phosphonium CAS Name: [[4-(2-amino-6-oxo-3H-purin-9-yl)-1-cyclopent-2-enyl]oxy-[difluoro(phosphono)methoxy]-[hydroxy(oxo)phosphiniumyl]methoxy]-hydroxy-oxophosphonium IUPAC Name: [[4-(2-amino-6-oxo-3H-purin-9-yl)cyclopent-2-en-1-yl]oxy-[difluoro(phosphono)methoxy]-[hydroxy(oxo)phosphaniumyl]methoxy]-hydroxy-oxophosphanium Traditional Name: [[4-(2-amino-6-keto-3H-purin-9-yl)cyclopent-2-en-1-yl]oxy-[difluoro(phosphono)methoxy]-[hydroxy(keto)phosphiniumyl]methoxy]-hydroxy-keto-phosphonium Formula: C12H14F2N5O11P3+2 MolecularWeight: 535.184549

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC1OC(OC(F)(F)P(=O)(O)O)(O[P+](=O)O)[P+](=O)O)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

C1C(C=CC1OC(OC(F)(F)P(=O)(O)O)(O[P+](=O)O)[P+](=O)O)N2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C12H11F2N5O11P3/c13-11(14,33(25,26)27)29-12(31(21)22,30-32(23)24)28-6-2-1-5(3-6)19-4-16-7-8(19)17-10(15)18-9(7)20/h1-2,4-6H,3H2,(H4-3,15,17,18,20,21,22,23,24,25,26,27)/q-1/p+3