2-[(2-chloranyl-7H-purin-6-yl)amino]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide

Systemtic Name: 2-[(2-chloranyl-7H-purin-6-yl)amino]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide Openeye Name: 2-[(2-chloro-7H-purin-6-yl)amino]-N-(2-morpholin-4-ium-4-ylethyl)acetamide CAS Name: 2-[(2-chloro-7H-purin-6-yl)amino]-N-[2-(4-morpholin-4-iumyl)ethyl]acetamide IUPAC Name: 2-[(2-chloro-7H-purin-6-yl)amino]-N-(2-morpholin-4-ium-4-ylethyl)acetamide Traditional Name: 2-[(2-chloro-7H-purin-6-yl)amino]-N-(2-morpholin-4-ium-4-ylethyl)acetamide Formula: C13H19ClN7O2+ MolecularWeight: 340.78866

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)CNC2=NC(=NC3=C2NC=N3)Cl

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)CNC2=NC(=NC3=C2NC=N3)Cl

InChI

InChI=1S/C13H18ClN7O2/c14-13-19-11(10-12(20-13)18-8-17-10)16-7-9(22)15-1-2-21-3-5-23-6-4-21/h8H,1-7H2,(H,15,22)(H2,16,17,18,19,20)/p+1