N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C18H11F6N3O2 MolecularWeight: 415.289259

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H11F6N3O2/c19-17(20,21)9-5-10(18(22,23)24)7-11(6-9)25-15(28)8-14-12-3-1-2-4-13(12)16(29)27-26-14/h1-7H,8H2,(H,25,28)(H,27,29)