N-methyl-N-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-7H-purin-6-amine

Systemtic Name: N-methyl-N-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-7H-purin-6-amine Openeye Name: N-methyl-N-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-7H-purin-6-amine CAS Name: N-methyl-N-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-7H-purin-6-amine IUPAC Name: N-methyl-N-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-7H-purin-6-amine Traditional Name: methyl-[2-(2-methyl-1H-imidazol-3-ium-3-yl)ethyl]-(7H-purin-6-yl)amine Formula: C12H16N7+ MolecularWeight: 258.30234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1)CCN(C)C2=NC=NC3=C2NC=N3

Isomeric SMILES

CC1=[N+](C=CN1)CCN(C)C2=NC=NC3=C2NC=N3

InChI

InChI=1S/C12H15N7/c1-9-13-3-4-19(9)6-5-18(2)12-10-11(15-7-14-10)16-8-17-12/h3-4,7-8H,5-6H2,1-2H3,(H,14,15,16,17)/p+1