[3-oxidanyl-5-(6-oxidanylidene-2-phenylazanyl-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [3-oxidanyl-5-(6-oxidanylidene-2-phenylazanyl-3H-purin-9-yl)oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [5-(2-anilino-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [5-(2-anilino-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [5-(2-anilino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [5-(2-anilino-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C16H18N5O7P MolecularWeight: 423.317181

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)NC4=CC=CC=C4)COP(=O)(O)O)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)NC4=CC=CC=C4)COP(=O)(O)O)O

InChI

InChI=1S/C16H18N5O7P/c22-10-6-12(28-11(10)7-27-29(24,25)26)21-8-17-13-14(21)19-16(20-15(13)23)18-9-4-2-1-3-5-9/h1-5,8,10-12,22H,6-7H2,(H2,24,25,26)(H2,18,19,20,23)