[2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]cyclohexyl]methyl dihydrogen phosphate

Systemtic Name: [2-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]cyclohexyl]methyl dihydrogen phosphate Openeye Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methyl]cyclohexyl]methyl dihydrogen phosphate CAS Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methyl]cyclohexyl]methyl dihydrogen phosphate IUPAC Name: [2-[(2-amino-6-oxo-3H-purin-9-yl)methyl]cyclohexyl]methyl dihydrogen phosphate Traditional Name: [2-[(2-amino-6-keto-3H-purin-9-yl)methyl]cyclohexyl]methyl dihydrogen phosphate Formula: C13H20N5O5P MolecularWeight: 357.302161

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CN2C=NC3=C2NC(=NC3=O)N)COP(=O)(O)O

Isomeric SMILES

C1CCC(C(C1)CN2C=NC3=C2NC(=NC3=O)N)COP(=O)(O)O

InChI

InChI=1S/C13H20N5O5P/c14-13-16-11-10(12(19)17-13)15-7-18(11)5-8-3-1-2-4-9(8)6-23-24(20,21)22/h7-9H,1-6H2,(H2,20,21,22)(H3,14,16,17,19)