N-[4-methyl-3-(trifluoromethyl)phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[4-methyl-3-(trifluoromethyl)phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[4-methyl-3-(trifluoromethyl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[4-methyl-3-(trifluoromethyl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[4-methyl-3-(trifluoromethyl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[4-methyl-3-(trifluoromethyl)phenyl]-3H-phthalazine-1-carboxamide Formula: C17H12F3N3O2 MolecularWeight: 347.29129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C17H12F3N3O2/c1-9-6-7-10(8-13(9)17(18,19)20)21-16(25)14-11-4-2-3-5-12(11)15(24)23-22-14/h2-8H,1H3,(H,21,25)(H,23,24)