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

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C17H9F6N3O2 MolecularWeight: 401.262679

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H9F6N3O2/c18-16(19,20)8-5-9(17(21,22)23)7-10(6-8)24-15(28)13-11-3-1-2-4-12(11)14(27)26-25-13/h1-7H,(H,24,28)(H,26,27)