1-[benzotriazol-1-yl-(3-bromanyl-4-nitro-phenyl)methyl]benzotriazole

Systemtic Name: 1-[benzotriazol-1-yl-(3-bromanyl-4-nitro-phenyl)methyl]benzotriazole Openeye Name: 1-[benzotriazol-1-yl-(3-bromo-4-nitro-phenyl)methyl]benzotriazole CAS Name: 1-[1-benzotriazolyl-(3-bromo-4-nitrophenyl)methyl]benzotriazole IUPAC Name: 1-[benzotriazol-1-yl-(3-bromo-4-nitrophenyl)methyl]benzotriazole Traditional Name: 1-[benzotriazol-1-yl-(3-bromo-4-nitro-phenyl)methyl]benzotriazole Formula: C19H12BrN7O2 MolecularWeight: 450.24828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(C3=CC(=C(C=C3)[N+](=O)[O-])Br)N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C(C3=CC(=C(C=C3)[N+](=O)[O-])Br)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C19H12BrN7O2/c20-13-11-12(9-10-16(13)27(28)29)19(25-17-7-3-1-5-14(17)21-23-25)26-18-8-4-2-6-15(18)22-24-26/h1-11,19H