3-[(2-azanylpurin-9-yl)methoxy]propane-1,2-diol; propan-1-amine

Systemtic Name: 3-[(2-azanylpurin-9-yl)methoxy]propane-1,2-diol; propan-1-amine Openeye Name: 3-[(2-aminopurin-9-yl)methoxy]propane-1,2-diol; propan-1-amine CAS Name: 3-[(2-amino-9-purinyl)methoxy]propane-1,2-diol; 1-propanamine IUPAC Name: 3-[(2-aminopurin-9-yl)methoxy]propane-1,2-diol; propan-1-amine Traditional Name: 3-[(2-aminopurin-9-yl)methoxy]propane-1,2-diol; propylamine Formula: C12H22N6O3 MolecularWeight: 298.34148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN.C1=C2C(=NC(=N1)N)N(C=N2)COCC(CO)O

Isomeric SMILES

CCCN.C1=C2C(=NC(=N1)N)N(C=N2)COCC(CO)O

InChI

InChI=1S/C9H13N5O3.C3H9N/c10-9-11-1-7-8(13-9)14(4-12-7)5-17-3-6(16)2-15;1-2-3-4/h1,4,6,15-16H,2-3,5H2,(H2,10,11,13);2-4H2,1H3