ethyl 4-(3,3-diphenylpropanoylamino)-1-(2-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(3,3-diphenylpropanoylamino)-1-(2-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-(3,3-diphenylpropanoylamino)-1-(o-tolyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(2-methylphenyl)-6-oxo-4-[(1-oxo-3,3-diphenylpropyl)amino]-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,3-diphenylpropanoylamino)-1-(2-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(3,3-diphenylpropanoylamino)-6-keto-1-(o-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C29H27N3O4 MolecularWeight: 481.54238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4C

InChI

InChI=1S/C29H27N3O4/c1-3-36-29(35)28-24(19-27(34)32(31-28)25-17-11-10-12-20(25)2)30-26(33)18-23(21-13-6-4-7-14-21)22-15-8-5-9-16-22/h4-17,19,23H,3,18H2,1-2H3,(H,30,33)