6-ethyl-1-oxidanidyl-N-(2-piperidin-1-ylethyl)-1,2,4-benzotriazin-1-ium-3-amine

Systemtic Name: 6-ethyl-1-oxidanidyl-N-(2-piperidin-1-ylethyl)-1,2,4-benzotriazin-1-ium-3-amine Openeye Name: 6-ethyl-1-oxido-N-[2-(1-piperidyl)ethyl]-1,2,4-benzotriazin-1-ium-3-amine CAS Name: 6-ethyl-1-oxido-N-[2-(1-piperidinyl)ethyl]-1,2,4-benzotriazin-1-ium-3-amine IUPAC Name: 6-ethyl-1-oxido-N-(2-piperidin-1-ylethyl)-1,2,4-benzotriazin-1-ium-3-amine Traditional Name: (6-ethyl-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)-(2-piperidinoethyl)amine Formula: C16H23N5O MolecularWeight: 301.38672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)[N+](=NC(=N2)NCCN3CCCCC3)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)[N+](=NC(=N2)NCCN3CCCCC3)[O-]

InChI

InChI=1S/C16H23N5O/c1-2-13-6-7-15-14(12-13)18-16(19-21(15)22)17-8-11-20-9-4-3-5-10-20/h6-7,12H,2-5,8-11H2,1H3,(H,17,18,19)