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

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-[3-(trifluoromethyl)phenyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[3-(trifluoromethyl)phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-[3-(trifluoromethyl)phenyl]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[3-(trifluoromethyl)phenyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[3-(trifluoromethyl)phenyl]phthalazine-1-carboxamide Formula: C23H16F3N3O2 MolecularWeight: 423.38725

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C23H16F3N3O2/c24-23(25,26)16-9-6-10-17(13-16)27-21(30)20-18-11-4-5-12-19(18)22(31)29(28-20)14-15-7-2-1-3-8-15/h1-13H,14H2,(H,27,30)