[1-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-(trimethylazaniumyl)propan-2-yl]oxymethyl-oxidanyl-phosphinate

Systemtic Name: [1-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-(trimethylazaniumyl)propan-2-yl]oxymethyl-oxidanyl-phosphinate Openeye Name: [1-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-2-(trimethylammonio)ethoxy]methyl-hydroxy-phosphinate CAS Name: [1-(2-amino-6-oxo-3H-purin-9-yl)-3-(trimethylammonio)propan-2-yl]oxymethyl-hydroxyphosphinate IUPAC Name: [1-(2-amino-6-oxo-3H-purin-9-yl)-3-(trimethylazaniumyl)propan-2-yl]oxymethyl-hydroxyphosphinate Traditional Name: [1-[(2-amino-6-keto-3H-purin-9-yl)methyl]-2-(trimethylammonio)ethoxy]methyl-hydroxy-phosphinate Formula: C12H21N6O5P MolecularWeight: 360.306101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CN1C=NC2=C1NC(=NC2=O)N)OCP(=O)(O)[O-]

Isomeric SMILES

C[N+](C)(C)CC(CN1C=NC2=C1NC(=NC2=O)N)OCP(=O)(O)[O-]

InChI

InChI=1S/C12H21N6O5P/c1-18(2,3)5-8(23-7-24(20,21)22)4-17-6-14-9-10(17)15-12(13)16-11(9)19/h6,8H,4-5,7H2,1-3H3,(H4-,13,15,16,19,20,21,22)