ethyl 4-[2-[3-(2,5-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-(2,5-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[3-(2,5-dimethylphenyl)-6-oxo-pyridazin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[3-(2,5-dimethylphenyl)-6-oxo-1-pyridazinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-(2,5-dimethylphenyl)-6-oxopyridazin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[3-(2,5-dimethylphenyl)-6-keto-pyridazin-1-yl]acetyl]amino]benzoic acid ethyl ester Formula: C23H23N3O4 MolecularWeight: 405.44642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C=CC(=N2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C=CC(=N2)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H23N3O4/c1-4-30-23(29)17-7-9-18(10-8-17)24-21(27)14-26-22(28)12-11-20(25-26)19-13-15(2)5-6-16(19)3/h5-13H,4,14H2,1-3H3,(H,24,27)