7-methyl-3-(phenylmethyl)purin-3-ium-6-amine

Systemtic Name: 7-methyl-3-(phenylmethyl)purin-3-ium-6-amine Openeye Name: 3-benzyl-7-methyl-purin-3-ium-6-amine CAS Name: 7-methyl-3-(phenylmethyl)-6-purin-3-iumamine IUPAC Name: 3-benzyl-7-methylpurin-3-ium-6-amine Traditional Name: (3-benzyl-7-methyl-purin-3-ium-6-yl)amine Formula: C13H14N5+ MolecularWeight: 240.28376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=[N+](C=NC(=C21)N)CC3=CC=CC=C3

Isomeric SMILES

CN1C=NC2=[N+](C=NC(=C21)N)CC3=CC=CC=C3

InChI

InChI=1S/C13H13N5/c1-17-8-16-13-11(17)12(14)15-9-18(13)7-10-5-3-2-4-6-10/h2-6,8-9,14H,7H2,1H3/p+1