2-[2-oxidanidyl-4,9-bis(oxidanylidene)benzo[f]benzotriazol-2-ium-3-yl]ethyl benzoate

Systemtic Name: 2-[2-oxidanidyl-4,9-bis(oxidanylidene)benzo[f]benzotriazol-2-ium-3-yl]ethyl benzoate Openeye Name: 2-(2-oxido-4,9-dioxo-benzo[f]benzotriazol-2-ium-3-yl)ethyl benzoate CAS Name: benzoic acid 2-(2-oxido-4,9-dioxo-3-benzo[f]benzotriazol-2-iumyl)ethyl ester IUPAC Name: 2-(2-oxido-4,9-dioxobenzo[f]benzotriazol-2-ium-3-yl)ethyl benzoate Traditional Name: benzoic acid 2-(4,9-diketo-2-oxido-benzo[f]benzotriazol-2-ium-3-yl)ethyl ester Formula: C19H13N3O5 MolecularWeight: 363.32362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCN2C3=C(C(=O)C4=CC=CC=C4C3=O)N=[N+]2[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCN2C3=C(C(=O)C4=CC=CC=C4C3=O)N=[N+]2[O-]

InChI

InChI=1S/C19H13N3O5/c23-17-13-8-4-5-9-14(13)18(24)16-15(17)20-22(26)21(16)10-11-27-19(25)12-6-2-1-3-7-12/h1-9H,10-11H2