[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic acid; N,N-dibutylbutan-1-amine

Systemtic Name: [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic acid; N,N-dibutylbutan-1-amine Openeye Name: [(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methylphosphonic acid; N,N-dibutylbutan-1-amine CAS Name: [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic acid; N,N-dibutyl-1-butanamine IUPAC Name: [(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic acid; N,N-dibutylbutan-1-amine Traditional Name: [(1R)-2-adenin-9-yl-1-methyl-ethoxy]methylphosphonic acid; tributylamine Formula: C21H41N6O4P MolecularWeight: 472.561801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCC.CC(CN1C=NC2=C1N=CN=C2N)OCP(=O)(O)O

Isomeric SMILES

CCCCN(CCCC)CCCC.C[C@H](CN1C=NC2=C1N=CN=C2N)OCP(=O)(O)O

InChI

InChI=1S/C12H27N.C9H14N5O4P/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h4-12H2,1-3H3;3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t;6-/m.1/s1