ethyl 4-[(4-butoxyphenyl)carbonylamino]-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[(4-butoxyphenyl)carbonylamino]-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(4-butoxybenzoyl)amino]-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 4-[[(4-butoxyphenyl)-oxomethyl]amino]-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-butoxybenzoyl)amino]-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[(4-butoxybenzoyl)amino]-6-keto-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C25H27N3O5 MolecularWeight: 449.49898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H27N3O5/c1-4-6-15-33-20-13-9-18(10-14-20)24(30)26-21-16-22(29)28(19-11-7-17(3)8-12-19)27-23(21)25(31)32-5-2/h7-14,16H,4-6,15H2,1-3H3,(H,26,30)