ethyl 3-[[6-oxidanylidene-1-(phenylmethyl)pyridazin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[6-oxidanylidene-1-(phenylmethyl)pyridazin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[(1-benzyl-6-oxo-pyridazine-3-carbonyl)amino]benzoate CAS Name: 3-[[oxo-[6-oxo-1-(phenylmethyl)-3-pyridazinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(1-benzyl-6-oxopyridazine-3-carbonyl)amino]benzoate Traditional Name: 3-[(1-benzyl-6-keto-pyridazine-3-carbonyl)amino]benzoic acid ethyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O4/c1-2-28-21(27)16-9-6-10-17(13-16)22-20(26)18-11-12-19(25)24(23-18)14-15-7-4-3-5-8-15/h3-13H,2,14H2,1H3,(H,22,26)