5-bromanyl-4-chloranyl-6-nitro-1-oxidanidyl-2-phenyl-benzotriazol-1-ium

Systemtic Name: 5-bromanyl-4-chloranyl-6-nitro-1-oxidanidyl-2-phenyl-benzotriazol-1-ium Openeye Name: 5-bromo-4-chloro-6-nitro-1-oxido-2-phenyl-benzotriazol-1-ium CAS Name: 5-bromo-4-chloro-6-nitro-1-oxido-2-phenylbenzotriazol-1-ium IUPAC Name: 5-bromo-4-chloro-6-nitro-1-oxido-2-phenylbenzotriazol-1-ium Traditional Name: 5-bromo-4-chloro-6-nitro-1-oxido-2-phenyl-benzotriazol-1-ium Formula: C12H6BrClN4O3 MolecularWeight: 369.55804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C3C(=[N+]2[O-])C=C(C(=C3Cl)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2N=C3C(=[N+]2[O-])C=C(C(=C3Cl)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H6BrClN4O3/c13-10-8(18(20)21)6-9-12(11(10)14)15-16(17(9)19)7-4-2-1-3-5-7/h1-6H