N-[[5-chloranyl-2-(2H-1,2,3,4-tetrazol-1-ium-1-yl)phenyl]methyl]azetidine-2-carboxamide

Systemtic Name: N-[[5-chloranyl-2-(2H-1,2,3,4-tetrazol-1-ium-1-yl)phenyl]methyl]azetidine-2-carboxamide Openeye Name: N-[[5-chloro-2-(2H-tetrazol-1-ium-1-yl)phenyl]methyl]azetidine-2-carboxamide CAS Name: N-[[5-chloro-2-(2H-tetrazol-1-ium-1-yl)phenyl]methyl]-2-azetidinecarboxamide IUPAC Name: N-[[5-chloro-2-(2H-tetrazol-1-ium-1-yl)phenyl]methyl]azetidine-2-carboxamide Traditional Name: N-[5-chloro-2-(2H-tetrazol-1-ium-1-yl)benzyl]azetidine-2-carboxamide Formula: C12H14ClN6O+ MolecularWeight: 293.73216

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC1C(=O)NCC2=C(C=CC(=C2)Cl)[N+]3=CN=NN3

Isomeric SMILES

C1CNC1C(=O)NCC2=C(C=CC(=C2)Cl)[N+]3=CN=NN3

InChI

InChI=1S/C12H13ClN6O/c13-9-1-2-11(19-7-16-17-18-19)8(5-9)6-15-12(20)10-3-4-14-10/h1-2,5,7,10,14H,3-4,6H2,(H,15,20)/p+1