[7-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)heptyl-oxidanyl-phosphoryl]methylphosphonic acid

Systemtic Name: [7-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)heptyl-oxidanyl-phosphoryl]methylphosphonic acid Openeye Name: [7-(2-amino-6-oxo-3H-purin-9-yl)heptyl-hydroxy-phosphoryl]methylphosphonic acid CAS Name: [7-(2-amino-6-oxo-3H-purin-9-yl)heptyl-hydroxyphosphoryl]methylphosphonic acid IUPAC Name: [7-(2-amino-6-oxo-3H-purin-9-yl)heptyl-hydroxyphosphoryl]methylphosphonic acid Traditional Name: [7-(2-amino-6-keto-3H-purin-9-yl)heptyl-hydroxy-phosphoryl]methylphosphonic acid Formula: C13H23N5O6P2 MolecularWeight: 407.299142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCCCCCCP(=O)(CP(=O)(O)O)O)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1CCCCCCCP(=O)(CP(=O)(O)O)O)NC(=NC2=O)N

InChI

InChI=1S/C13H23N5O6P2/c14-13-16-11-10(12(19)17-13)15-8-18(11)6-4-2-1-3-5-7-25(20,21)9-26(22,23)24/h8H,1-7,9H2,(H,20,21)(H2,22,23,24)(H3,14,16,17,19)