5-bromanyl-3-chloranyl-7-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium

Systemtic Name: 5-bromanyl-3-chloranyl-7-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium Openeye Name: 5-bromo-3-chloro-7-methyl-1-oxido-1,2,4-benzotriazin-1-ium CAS Name: 5-bromo-3-chloro-7-methyl-1-oxido-1,2,4-benzotriazin-1-ium IUPAC Name: 5-bromo-3-chloro-7-methyl-1-oxido-1,2,4-benzotriazin-1-ium Traditional Name: 5-bromo-3-chloro-7-methyl-1-oxido-1,2,4-benzotriazin-1-ium Formula: C8H5BrClN3O MolecularWeight: 274.5018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)Br)N=C(N=[N+]2[O-])Cl

Isomeric SMILES

CC1=CC2=C(C(=C1)Br)N=C(N=[N+]2[O-])Cl

InChI

InChI=1S/C8H5BrClN3O/c1-4-2-5(9)7-6(3-4)13(14)12-8(10)11-7/h2-3H,1H3