ethyl 4-(4-ethoxycarbonylpiperidin-1-yl)-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(4-ethoxycarbonylpiperidin-1-yl)-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-(4-ethoxycarbonyl-1-piperidyl)-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 4-(4-ethoxycarbonyl-1-piperidinyl)-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxycarbonylpiperidin-1-yl)-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(4-carbethoxypiperidino)-6-keto-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H27N3O5/c1-4-29-21(27)16-10-12-24(13-11-16)18-14-19(26)25(17-8-6-15(3)7-9-17)23-20(18)22(28)30-5-2/h6-9,14,16H,4-5,10-13H2,1-3H3