1-[[4-[3-[4-(benzotriazol-1-ylmethyl)phenyl]-2-bromanyl-phenyl]phenyl]methyl]benzotriazole

Systemtic Name: 1-[[4-[3-[4-(benzotriazol-1-ylmethyl)phenyl]-2-bromanyl-phenyl]phenyl]methyl]benzotriazole Openeye Name: 1-[[4-[3-[4-(benzotriazol-1-ylmethyl)phenyl]-2-bromo-phenyl]phenyl]methyl]benzotriazole CAS Name: 1-[[4-[3-[4-(1-benzotriazolylmethyl)phenyl]-2-bromophenyl]phenyl]methyl]benzotriazole IUPAC Name: 1-[[4-[3-[4-(benzotriazol-1-ylmethyl)phenyl]-2-bromophenyl]phenyl]methyl]benzotriazole Traditional Name: 1-[4-[3-[4-(benzotriazol-1-ylmethyl)phenyl]-2-bromo-phenyl]benzyl]benzotriazole Formula: C32H23BrN6 MolecularWeight: 571.46922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C4=C(C(=CC=C4)C5=CC=C(C=C5)CN6C7=CC=CC=C7N=N6)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC3=CC=C(C=C3)C4=C(C(=CC=C4)C5=CC=C(C=C5)CN6C7=CC=CC=C7N=N6)Br

InChI

InChI=1S/C32H23BrN6/c33-32-26(24-16-12-22(13-17-24)20-38-30-10-3-1-8-28(30)34-36-38)6-5-7-27(32)25-18-14-23(15-19-25)21-39-31-11-4-2-9-29(31)35-37-39/h1-19H,20-21H2