2-[(2-chloranyl-7H-purin-6-yl)amino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-[(2-chloranyl-7H-purin-6-yl)amino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-[(2-chloro-7H-purin-6-yl)amino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[(2-chloro-7H-purin-6-yl)amino]-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-[(2-chloro-7H-purin-6-yl)amino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[(2-chloro-7H-purin-6-yl)amino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)acetamide Formula: C16H25ClN7O+ MolecularWeight: 366.869

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)CNC2=NC(=NC3=C2NC=N3)Cl)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)CNC2=NC(=NC3=C2NC=N3)Cl)C

InChI

InChI=1S/C16H24ClN7O/c1-15(2)5-9(6-16(3,4)24-15)21-10(25)7-18-12-11-13(20-8-19-11)23-14(17)22-12/h8-9,24H,5-7H2,1-4H3,(H,21,25)(H2,18,19,20,22,23)/p+1