3-methyl-N-phenyl-7H-purin-3-ium-6-amine

Systemtic Name: 3-methyl-N-phenyl-7H-purin-3-ium-6-amine Openeye Name: 3-methyl-N-phenyl-7H-purin-3-ium-6-amine CAS Name: 3-methyl-N-phenyl-7H-purin-3-ium-6-amine IUPAC Name: 3-methyl-N-phenyl-7H-purin-3-ium-6-amine Traditional Name: (3-methyl-7H-purin-3-ium-6-yl)-phenyl-amine Formula: C12H12N5+ MolecularWeight: 226.25718

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C(=C(N=C1)NC3=CC=CC=C3)NC=N2

Isomeric SMILES

C[N+]1=C2C(=C(N=C1)NC3=CC=CC=C3)NC=N2

InChI

InChI=1S/C12H11N5/c1-17-8-15-11(10-12(17)14-7-13-10)16-9-5-3-2-4-6-9/h2-8H,1H3,(H,13,14,16)/p+1