1-(1H-imidazol-5-yl)-N-[(4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-yl)methyl]-1-piperidin-4-yl-methanamine

Systemtic Name: 1-(1H-imidazol-5-yl)-N-[(4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-yl)methyl]-1-piperidin-4-yl-methanamine Openeye Name: 1-(1H-imidazol-5-yl)-N-[(4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)methyl]-1-(4-piperidyl)methanamine CAS Name: 1-(1H-imidazol-5-yl)-N-[(4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)methyl]-1-(4-piperidinyl)methanamine IUPAC Name: 1-(1H-imidazol-5-yl)-N-[(4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)methyl]-1-piperidin-4-ylmethanamine Traditional Name: [1H-imidazol-5-yl(4-piperidyl)methyl]-[(4-methyl-5-oxido-furazan-5-ium-3-yl)methyl]amine Formula: C13H20N6O2 MolecularWeight: 292.3369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](ON=C1CNC(C2CCNCC2)C3=CN=CN3)[O-]

Isomeric SMILES

CC1=[N+](ON=C1CNC(C2CCNCC2)C3=CN=CN3)[O-]

InChI

InChI=1S/C13H20N6O2/c1-9-11(18-21-19(9)20)7-16-13(12-6-15-8-17-12)10-2-4-14-5-3-10/h6,8,10,13-14,16H,2-5,7H2,1H3,(H,15,17)