5-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-8-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-amine

Systemtic Name: 5-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-8-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-amine Openeye Name: 5-[2-(2,6-dimethyl-1-piperidyl)ethyl]-8-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-amine CAS Name: 5-[2-(2,6-dimethyl-1-piperidinyl)ethyl]-8-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-amine IUPAC Name: 5-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-8-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-amine Traditional Name: [5-[2-(2,6-dimethylpiperidino)ethyl]-8-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-yl]amine Formula: C17H25N5O MolecularWeight: 315.4133

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCC2=C3C(=C(C=C2)C)[N+](=NC(=N3)N)[O-])C

Isomeric SMILES

CC1CCCC(N1CCC2=C3C(=C(C=C2)C)[N+](=NC(=N3)N)[O-])C

InChI

InChI=1S/C17H25N5O/c1-11-7-8-14(15-16(11)22(23)20-17(18)19-15)9-10-21-12(2)5-4-6-13(21)3/h7-8,12-13H,4-6,9-10H2,1-3H3,(H2,18,19,20)