3-[2-[(2-chloranyl-7H-purin-6-yl)amino]ethanoylamino]propyl-diethyl-azanium

Systemtic Name: 3-[2-[(2-chloranyl-7H-purin-6-yl)amino]ethanoylamino]propyl-diethyl-azanium Openeye Name: 3-[[2-[(2-chloro-7H-purin-6-yl)amino]acetyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[2-[(2-chloro-7H-purin-6-yl)amino]-1-oxoethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[2-[(2-chloro-7H-purin-6-yl)amino]acetyl]amino]propyl-diethylazanium Traditional Name: 3-[[2-[(2-chloro-7H-purin-6-yl)amino]acetyl]amino]propyl-diethyl-ammonium Formula: C14H23ClN7O+ MolecularWeight: 340.83172

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)CNC1=NC(=NC2=C1NC=N2)Cl

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)CNC1=NC(=NC2=C1NC=N2)Cl

InChI

InChI=1S/C14H22ClN7O/c1-3-22(4-2)7-5-6-16-10(23)8-17-12-11-13(19-9-18-11)21-14(15)20-12/h9H,3-8H2,1-2H3,(H,16,23)(H2,17,18,19,20,21)/p+1