8-chloranyl-3-(1-methyl-1,2,4-triazol-3-yl)-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium

Systemtic Name: 8-chloranyl-3-(1-methyl-1,2,4-triazol-3-yl)-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Openeye Name: 8-chloro-3-(1-methyl-1,2,4-triazol-3-yl)-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium CAS Name: 8-chloro-3-(1-methyl-1,2,4-triazol-3-yl)-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium IUPAC Name: 8-chloro-3-(1-methyl-1,2,4-triazol-3-yl)-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Traditional Name: 8-chloro-3-(1-methyl-1,2,4-triazol-3-yl)-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium Formula: C12H8ClN7O MolecularWeight: 301.69122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=N1)C2=C3N=[N+](C4=C(N3N=C2)C=C(C=C4)Cl)[O-]

Isomeric SMILES

CN1C=NC(=N1)C2=C3N=[N+](C4=C(N3N=C2)C=C(C=C4)Cl)[O-]

InChI

InChI=1S/C12H8ClN7O/c1-18-6-14-11(16-18)8-5-15-19-10-4-7(13)2-3-9(10)20(21)17-12(8)19/h2-6H,1H3