dimethyl 5-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(1-oxophthalazin-2-yl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-(1-oxo-2-phthalazinyl)ethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(1-oxophthalazin-2-yl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(1-ketophthalazin-2-yl)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H17N3O6 MolecularWeight: 395.36548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C=N2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C=N2)C(=O)OC

InChI

InChI=1S/C20H17N3O6/c1-28-19(26)13-7-14(20(27)29-2)9-15(8-13)22-17(24)11-23-18(25)16-6-4-3-5-12(16)10-21-23/h3-10H,11H2,1-2H3,(H,22,24)