2-oxidanidyl-3-[[4-(phenylcarbonyl)phenyl]methyl]benzo[f]benzotriazol-2-ium-4,9-dione

Systemtic Name: 2-oxidanidyl-3-[[4-(phenylcarbonyl)phenyl]methyl]benzo[f]benzotriazol-2-ium-4,9-dione Openeye Name: 3-[(4-benzoylphenyl)methyl]-2-oxido-benzo[f]benzotriazol-2-ium-4,9-dione CAS Name: 3-[(4-benzoylphenyl)methyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione IUPAC Name: 3-[(4-benzoylphenyl)methyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione Traditional Name: 3-(4-benzoylbenzyl)-2-oxido-benzo[f]benzotriazol-2-ium-4,9-quinone Formula: C24H15N3O4 MolecularWeight: 409.3936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CN3C4=C(C(=O)C5=CC=CC=C5C4=O)N=[N+]3[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CN3C4=C(C(=O)C5=CC=CC=C5C4=O)N=[N+]3[O-]

InChI

InChI=1S/C24H15N3O4/c28-22(16-6-2-1-3-7-16)17-12-10-15(11-13-17)14-26-21-20(25-27(26)31)23(29)18-8-4-5-9-19(18)24(21)30/h1-13H,14H2