dimethyl 2-[2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)ethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-(4-keto-1,2,3-benzotriazin-3-yl)acetyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C19H16N4O6 MolecularWeight: 396.35354

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C19H16N4O6/c1-28-18(26)11-7-8-13(19(27)29-2)15(9-11)20-16(24)10-23-17(25)12-5-3-4-6-14(12)21-22-23/h3-9H,10H2,1-2H3,(H,20,24)