N-[3,5-bis(trifluoromethyl)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C18H11F6N3O2 MolecularWeight: 415.289259

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H11F6N3O2/c1-27-16(29)13-5-3-2-4-12(13)14(26-27)15(28)25-11-7-9(17(19,20)21)6-10(8-11)18(22,23)24/h2-8H,1H3,(H,25,28)