6-chloranyl-1-oxidanidyl-4-oxidanyl-N-(2-piperidin-1-ylethyl)-1,2,4-benzotriazin-1-ium-3-imine

Systemtic Name: 6-chloranyl-1-oxidanidyl-4-oxidanyl-N-(2-piperidin-1-ylethyl)-1,2,4-benzotriazin-1-ium-3-imine Openeye Name: 6-chloro-4-hydroxy-1-oxido-N-[2-(1-piperidyl)ethyl]-1,2,4-benzotriazin-1-ium-3-imine CAS Name: 6-chloro-4-hydroxy-1-oxido-N-[2-(1-piperidinyl)ethyl]-1,2,4-benzotriazin-1-ium-3-imine IUPAC Name: 6-chloro-4-hydroxy-1-oxido-N-(2-piperidin-1-ylethyl)-1,2,4-benzotriazin-1-ium-3-imine Traditional Name: (6-chloro-4-hydroxy-1-oxido-1,2,4-benzotriazin-1-ium-3-ylidene)-(2-piperidinoethyl)amine Formula: C14H18ClN5O2 MolecularWeight: 323.77802

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCN=C2N=[N+](C3=C(N2O)C=C(C=C3)Cl)[O-]

Isomeric SMILES

C1CCN(CC1)CCN=C2N=[N+](C3=C(N2O)C=C(C=C3)Cl)[O-]

InChI

InChI=1S/C14H18ClN5O2/c15-11-4-5-12-13(10-11)19(21)14(17-20(12)22)16-6-9-18-7-2-1-3-8-18/h4-5,10,21H,1-3,6-9H2