6-tert-butyl-3-chloranyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium

Systemtic Name: 6-tert-butyl-3-chloranyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium Openeye Name: 6-tert-butyl-3-chloro-1-oxido-1,2,4-benzotriazin-1-ium CAS Name: 6-tert-butyl-3-chloro-1-oxido-1,2,4-benzotriazin-1-ium IUPAC Name: 6-tert-butyl-3-chloro-1-oxido-1,2,4-benzotriazin-1-ium Traditional Name: 6-tert-butyl-3-chloro-1-oxido-1,2,4-benzotriazin-1-ium Formula: C11H12ClN3O MolecularWeight: 237.68548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)[N+](=NC(=N2)Cl)[O-]

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)[N+](=NC(=N2)Cl)[O-]

InChI

InChI=1S/C11H12ClN3O/c1-11(2,3)7-4-5-9-8(6-7)13-10(12)14-15(9)16/h4-6H,1-3H3