ethyl 4-[methyl-(1-methylpiperidin-4-yl)amino]-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[methyl-(1-methylpiperidin-4-yl)amino]-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[methyl-(1-methyl-4-piperidyl)amino]-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 4-[methyl-(1-methyl-4-piperidinyl)amino]-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[methyl-(1-methylpiperidin-4-yl)amino]-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 6-keto-4-[methyl-(1-methyl-4-piperidyl)amino]-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1N(C)C2CCN(CC2)C)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1N(C)C2CCN(CC2)C)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H28N4O3/c1-5-28-21(27)20-18(24(4)16-10-12-23(3)13-11-16)14-19(26)25(22-20)17-8-6-15(2)7-9-17/h6-9,14,16H,5,10-13H2,1-4H3