2-[2-[(2-chloranyl-7H-purin-6-yl)amino]ethanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-[(2-chloranyl-7H-purin-6-yl)amino]ethanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-[(2-chloro-7H-purin-6-yl)amino]acetyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-[(2-chloro-7H-purin-6-yl)amino]-1-oxoethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-[(2-chloro-7H-purin-6-yl)amino]acetyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-[(2-chloro-7H-purin-6-yl)amino]acetyl]amino]ethyl-dimethyl-ammonium Formula: C11H17ClN7O+ MolecularWeight: 298.75198

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)CNC1=NC(=NC2=C1NC=N2)Cl

Isomeric SMILES

C[NH+](C)CCNC(=O)CNC1=NC(=NC2=C1NC=N2)Cl

InChI

InChI=1S/C11H16ClN7O/c1-19(2)4-3-13-7(20)5-14-9-8-10(16-6-15-8)18-11(12)17-9/h6H,3-5H2,1-2H3,(H,13,20)(H2,14,15,16,17,18)/p+1