ethyl 4-[2-(3,4-dimethoxyphenyl)ethanoylamino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[2-(3,4-dimethoxyphenyl)ethanoylamino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]-1-(4-fluorophenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-4-(homoveratroylamino)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C23H22FN3O6 MolecularWeight: 455.435683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2=CC(=C(C=C2)OC)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)CC2=CC(=C(C=C2)OC)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H22FN3O6/c1-4-33-23(30)22-17(13-21(29)27(26-22)16-8-6-15(24)7-9-16)25-20(28)12-14-5-10-18(31-2)19(11-14)32-3/h5-11,13H,4,12H2,1-3H3,(H,25,28)