N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]phthalazine-1-carboxamide Formula: C22H22F3N3O4 MolecularWeight: 449.42299

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)OCCOC

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)OCCOC

InChI

InChI=1S/C22H22F3N3O4/c1-13(2)28-21(30)16-7-5-4-6-15(16)19(27-28)20(29)26-17-12-14(22(23,24)25)8-9-18(17)32-11-10-31-3/h4-9,12-13H,10-11H2,1-3H3,(H,26,29)