ethyl 4-ethanoyl-3-morpholin-4-yl-6-[3-(trifluoromethyl)phenyl]-3H-pyridazine-2-carboxylate

Systemtic Name: ethyl 4-ethanoyl-3-morpholin-4-yl-6-[3-(trifluoromethyl)phenyl]-3H-pyridazine-2-carboxylate Openeye Name: ethyl 4-acetyl-3-morpholino-6-[3-(trifluoromethyl)phenyl]-3H-pyridazine-2-carboxylate CAS Name: 4-acetyl-3-(4-morpholinyl)-6-[3-(trifluoromethyl)phenyl]-3H-pyridazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-3-morpholin-4-yl-6-[3-(trifluoromethyl)phenyl]-3H-pyridazine-2-carboxylate Traditional Name: 4-acetyl-3-morpholino-6-[3-(trifluoromethyl)phenyl]-3H-pyridazine-2-carboxylic acid ethyl ester Formula: C20H22F3N3O4 MolecularWeight: 425.40159

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C(=CC(=N1)C2=CC(=CC=C2)C(F)(F)F)C(=O)C)N3CCOCC3

Isomeric SMILES

CCOC(=O)N1C(C(=CC(=N1)C2=CC(=CC=C2)C(F)(F)F)C(=O)C)N3CCOCC3

InChI

InChI=1S/C20H22F3N3O4/c1-3-30-19(28)26-18(25-7-9-29-10-8-25)16(13(2)27)12-17(24-26)14-5-4-6-15(11-14)20(21,22)23/h4-6,11-12,18H,3,7-10H2,1-2H3