(3R)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-N-[2-morpholino-5-(trifluoromethyl)phenyl]-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-1-keto-N-[2-morpholino-5-(trifluoromethyl)phenyl]isochroman-3-carboxamide Formula: C21H19F3N2O4 MolecularWeight: 420.38177

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=O)[C@H]3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H19F3N2O4/c22-21(23,24)14-5-6-17(26-7-9-29-10-8-26)16(12-14)25-19(27)18-11-13-3-1-2-4-15(13)20(28)30-18/h1-6,12,18H,7-11H2,(H,25,27)/t18-/m1/s1