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

Systemtic Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]phthalazine-1-carboxamide Formula: C24H26F3N3O4 MolecularWeight: 477.47615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)OCCOC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)OCCOC

InChI

InChI=1S/C24H26F3N3O4/c1-3-4-7-12-30-23(32)18-9-6-5-8-17(18)21(29-30)22(31)28-19-15-16(24(25,26)27)10-11-20(19)34-14-13-33-2/h5-6,8-11,15H,3-4,7,12-14H2,1-2H3,(H,28,31)