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

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-2-oxidanidyl-benzo[f]benzotriazol-2-ium-4,9-dione Openeye Name: 3-[(4-methoxyphenyl)methyl]-2-oxido-benzo[f]benzotriazol-2-ium-4,9-dione CAS Name: 3-[(4-methoxyphenyl)methyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione IUPAC Name: 3-[(4-methoxyphenyl)methyl]-2-oxidobenzo[f]benzotriazol-2-ium-4,9-dione Traditional Name: 2-oxido-3-p-anisyl-benzo[f]benzotriazol-2-ium-4,9-quinone Formula: C18H13N3O4 MolecularWeight: 335.31352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=C(C(=O)C4=CC=CC=C4C3=O)N=[N+]2[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=C(C(=O)C4=CC=CC=C4C3=O)N=[N+]2[O-]

InChI

InChI=1S/C18H13N3O4/c1-25-12-8-6-11(7-9-12)10-20-16-15(19-21(20)24)17(22)13-4-2-3-5-14(13)18(16)23/h2-9H,10H2,1H3