butyl 4-[(4-oxidanylidene-1-phenyl-pyridazin-3-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(4-oxidanylidene-1-phenyl-pyridazin-3-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(4-oxo-1-phenyl-pyridazine-3-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(4-oxo-1-phenyl-3-pyridazinyl)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-oxo-1-phenylpyridazine-3-carbonyl)amino]benzoate Traditional Name: 4-[(4-keto-1-phenyl-pyridazine-3-carbonyl)amino]benzoic acid butyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C=CC2=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C=CC2=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O4/c1-2-3-15-29-22(28)16-9-11-17(12-10-16)23-21(27)20-19(26)13-14-25(24-20)18-7-5-4-6-8-18/h4-14H,2-3,15H2,1H3,(H,23,27)