7-(1-phenylpropoxy)-2H-[1,2,3]triazolo[4,5-d]pyrimidin-6-ium-5-amine

Systemtic Name: 7-(1-phenylpropoxy)-2H-[1,2,3]triazolo[4,5-d]pyrimidin-6-ium-5-amine Openeye Name: 7-(1-phenylpropoxy)-2H-triazolo[4,5-d]pyrimidin-6-ium-5-amine CAS Name: 7-(1-phenylpropoxy)-2H-triazolo[4,5-d]pyrimidin-6-ium-5-amine IUPAC Name: 7-(1-phenylpropoxy)-2H-triazolo[4,5-d]pyrimidin-6-ium-5-amine Traditional Name: [7-(1-phenylpropoxy)-2H-triazolo[4,5-d]pyrimidin-6-ium-5-yl]amine Formula: C13H15N6O+ MolecularWeight: 271.2978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)OC2=[NH+]C(=NC3=NNN=C23)N

Isomeric SMILES

CCC(C1=CC=CC=C1)OC2=[NH+]C(=NC3=NNN=C23)N

InChI

InChI=1S/C13H14N6O/c1-2-9(8-6-4-3-5-7-8)20-12-10-11(18-19-17-10)15-13(14)16-12/h3-7,9H,2H2,1H3,(H3,14,15,16,17,18,19)/p+1