dimethyl 2-[4-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)butanoylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[4-(6-oxidanylidene-3-phenyl-pyridazin-1-yl)butanoylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[4-(6-oxo-3-phenyl-pyridazin-1-yl)butanoylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[1-oxo-4-(6-oxo-3-phenyl-1-pyridazinyl)butyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[4-(6-oxo-3-phenylpyridazin-1-yl)butanoylamino]benzene-1,4-dicarboxylate Traditional Name: 2-[4-(6-keto-3-phenyl-pyridazin-1-yl)butanoylamino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C24H23N3O6 MolecularWeight: 449.45592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C24H23N3O6/c1-32-23(30)17-10-11-18(24(31)33-2)20(15-17)25-21(28)9-6-14-27-22(29)13-12-19(26-27)16-7-4-3-5-8-16/h3-5,7-8,10-13,15H,6,9,14H2,1-2H3,(H,25,28)