2-chloranyl-6-(4-methylpiperazin-4-ium-1-yl)-7H-purine

Systemtic Name: 2-chloranyl-6-(4-methylpiperazin-4-ium-1-yl)-7H-purine Openeye Name: 2-chloro-6-(4-methylpiperazin-4-ium-1-yl)-7H-purine CAS Name: 2-chloro-6-(4-methyl-1-piperazin-4-iumyl)-7H-purine IUPAC Name: 2-chloro-6-(4-methylpiperazin-4-ium-1-yl)-7H-purine Traditional Name: 2-chloro-6-(4-methylpiperazin-4-ium-1-yl)-7H-purine Formula: C10H14ClN6+ MolecularWeight: 253.71136

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=NC3=C2NC=N3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=NC3=C2NC=N3)Cl

InChI

InChI=1S/C10H13ClN6/c1-16-2-4-17(5-3-16)9-7-8(13-6-12-7)14-10(11)15-9/h6H,2-5H2,1H3,(H,12,13,14,15)/p+1