N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[2-morpholino-5-(trifluoromethyl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-morpholino-5-(trifluoromethyl)phenyl]-3H-phthalazine-1-carboxamide Formula: C20H17F3N4O3 MolecularWeight: 418.36919

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H17F3N4O3/c21-20(22,23)12-5-6-16(27-7-9-30-10-8-27)15(11-12)24-19(29)17-13-3-1-2-4-14(13)18(28)26-25-17/h1-6,11H,7-10H2,(H,24,29)(H,26,28)