O1-methyl O4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl] benzene-1,4-dicarboxylate

Systemtic Name: O1-methyl O4-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl] ester IUPAC Name: 1-O-methyl 4-O-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(4-keto-1,2,3-benzotriazin-3-yl)methyl] ester O1-methyl ester Formula: C17H13N3O5 MolecularWeight: 339.30222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H13N3O5/c1-24-16(22)11-6-8-12(9-7-11)17(23)25-10-20-15(21)13-4-2-3-5-14(13)18-19-20/h2-9H,10H2,1H3