(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1,4-bis(oxidanyl)naphthalene-2-carboxylate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 1,4-bis(oxidanyl)naphthalene-2-carboxylate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1,4-dihydroxynaphthalene-2-carboxylate CAS Name: 1,4-dihydroxy-2-naphthalenecarboxylic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 1,4-dihydroxynaphthalene-2-carboxylate Traditional Name: 1,4-dihydroxynaphthalene-2-carboxylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C19H13N3O5 MolecularWeight: 363.32362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)OCN3C(=O)C4=CC=CC=C4N=N3)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2O)C(=O)OCN3C(=O)C4=CC=CC=C4N=N3)O

InChI

InChI=1S/C19H13N3O5/c23-16-9-14(17(24)12-6-2-1-5-11(12)16)19(26)27-10-22-18(25)13-7-3-4-8-15(13)20-21-22/h1-9,23-24H,10H2