2-azanyl-9-[2-[[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxy-phosphoryl]methoxy]ethyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[2-[[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxy-phosphoryl]methoxy]ethyl]-3H-purin-6-one Openeye Name: 2-amino-9-[2-[[diisopropoxyphosphorylmethyl(isopropoxy)phosphoryl]methoxy]ethyl]-3H-purin-6-one CAS Name: 2-amino-9-[2-[[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]methoxy]ethyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[2-[[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]methoxy]ethyl]-3H-purin-6-one Traditional Name: 2-amino-9-[2-[[diisopropoxyphosphorylmethyl(isopropoxy)phosphoryl]methoxy]ethyl]-3H-purin-6-one Formula: C18H33N5O7P2 MolecularWeight: 493.431442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(COCCN1C=NC2=C1NC(=NC2=O)N)CP(=O)(OC(C)C)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(COCCN1C=NC2=C1NC(=NC2=O)N)CP(=O)(OC(C)C)OC(C)C

InChI

InChI=1S/C18H33N5O7P2/c1-12(2)28-31(25,11-32(26,29-13(3)4)30-14(5)6)10-27-8-7-23-9-20-15-16(23)21-18(19)22-17(15)24/h9,12-14H,7-8,10-11H2,1-6H3,(H3,19,21,22,24)