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

Systemtic Name: N-cyclopropyl-4-oxidanylidene-N-[[4-(trifluoromethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide Openeye Name: N-cyclopropyl-4-oxo-N-[[4-(trifluoromethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide CAS Name: N-cyclopropyl-4-oxo-N-[[4-(trifluoromethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide IUPAC Name: N-cyclopropyl-4-oxo-N-[[4-(trifluoromethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide Traditional Name: N-cyclopropyl-4-keto-N-[4-(trifluoromethyl)benzyl]-3H-phthalazine-1-carboxamide Formula: C20H16F3N3O2 MolecularWeight: 387.35515

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=C(C=C2)C(F)(F)F)C(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CC1N(CC2=CC=C(C=C2)C(F)(F)F)C(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H16F3N3O2/c21-20(22,23)13-7-5-12(6-8-13)11-26(14-9-10-14)19(28)17-15-3-1-2-4-16(15)18(27)25-24-17/h1-8,14H,9-11H2,(H,25,27)