[3-[2-(benzotriazol-1-ium-2-yl)ethyl]-6-(4-bromophenyl)-2-oxidanyl-4-phenyl-phenyl]-phenyl-methanone

Systemtic Name: [3-[2-(benzotriazol-1-ium-2-yl)ethyl]-6-(4-bromophenyl)-2-oxidanyl-4-phenyl-phenyl]-phenyl-methanone Openeye Name: [3-[2-(benzotriazol-1-ium-2-yl)ethyl]-6-(4-bromophenyl)-2-hydroxy-4-phenyl-phenyl]-phenyl-methanone CAS Name: [3-[2-(2-benzotriazol-1-iumyl)ethyl]-6-(4-bromophenyl)-2-hydroxy-4-phenylphenyl]-phenylmethanone IUPAC Name: [3-[2-(benzotriazol-1-ium-2-yl)ethyl]-6-(4-bromophenyl)-2-hydroxy-4-phenylphenyl]-phenylmethanone Traditional Name: [3-[2-(benzotriazol-1-ium-2-yl)ethyl]-6-(4-bromophenyl)-2-hydroxy-4-phenyl-phenyl]-phenyl-methanone Formula: C33H25BrN3O2+ MolecularWeight: 575.4745

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=C(C(=C2)C3=CC=C(C=C3)Br)C(=O)C4=CC=CC=C4)O)CCN5[NH+]=C6C=CC=CC6=N5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=C(C(=C2)C3=CC=C(C=C3)Br)C(=O)C4=CC=CC=C4)O)CCN5[NH+]=C6C=CC=CC6=N5

InChI

InChI=1S/C33H24BrN3O2/c34-25-17-15-23(16-18-25)28-21-27(22-9-3-1-4-10-22)26(19-20-37-35-29-13-7-8-14-30(29)36-37)33(39)31(28)32(38)24-11-5-2-6-12-24/h1-18,21,39H,19-20H2/p+1