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

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C22H13ClF3N3O2 MolecularWeight: 443.80573

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F

InChI

InChI=1S/C22H13ClF3N3O2/c23-18-11-10-13(12-17(18)22(24,25)26)27-20(30)19-15-8-4-5-9-16(15)21(31)29(28-19)14-6-2-1-3-7-14/h1-12H,(H,27,30)