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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)OCCOC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)OCCOC

InChI

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