6-chloranyl-2-pentyl-7H-purin-9-ium chloride

Systemtic Name: 6-chloranyl-2-pentyl-7H-purin-9-ium chloride Openeye Name: 6-chloro-2-pentyl-7H-purin-9-ium chloride CAS Name: 6-chloro-2-pentyl-7H-purin-9-ium chloride IUPAC Name: 6-chloro-2-pentyl-7H-purin-9-ium chloride Traditional Name: 2-amyl-6-chloro-7H-purin-9-ium chloride Formula: C10H14Cl2N4 MolecularWeight: 261.15096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC2=C(C(=N1)Cl)NC=[NH+]2.[Cl-]

Isomeric SMILES

CCCCCC1=NC2=C(C(=N1)Cl)NC=[NH+]2.[Cl-]

InChI

InChI=1S/C10H13ClN4.ClH/c1-2-3-4-5-7-14-9(11)8-10(15-7)13-6-12-8;/h6H,2-5H2,1H3,(H,12,13,14,15);1H