7-chloranyl-3-(4-ethylpyrazol-1-yl)-1-oxidanidyl-2H-1,2,3-benzotriazin-1-ium

Systemtic Name: 7-chloranyl-3-(4-ethylpyrazol-1-yl)-1-oxidanidyl-2H-1,2,3-benzotriazin-1-ium Openeye Name: 7-chloro-3-(4-ethylpyrazol-1-yl)-1-oxido-2H-1,2,3-benzotriazin-1-ium CAS Name: 7-chloro-3-(4-ethyl-1-pyrazolyl)-1-oxido-2H-1,2,3-benzotriazin-1-ium IUPAC Name: 7-chloro-3-(4-ethylpyrazol-1-yl)-1-oxido-2H-1,2,3-benzotriazin-1-ium Traditional Name: 7-chloro-3-(4-ethylpyrazol-1-yl)-1-oxido-2H-1,2,3-benzotriazin-1-ium Formula: C12H12ClN5O MolecularWeight: 277.70958

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(N=C1)N2C=C3C=CC(=CC3=[N+](N2)[O-])Cl

Isomeric SMILES

CCC1=CN(N=C1)N2C=C3C=CC(=CC3=[N+](N2)[O-])Cl

InChI

InChI=1S/C12H12ClN5O/c1-2-9-6-14-16(7-9)17-8-10-3-4-11(13)5-12(10)18(19)15-17/h3-8,15H,2H2,1H3