(3S)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3S)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-[2-pyrrolidino-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C20H19F3N2O3 MolecularWeight: 392.37167

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)[C@@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H19F3N2O3/c21-20(22,23)13-7-8-15(25-9-3-4-10-25)14(11-13)24-19(26)18-12-27-16-5-1-2-6-17(16)28-18/h1-2,5-8,11,18H,3-4,9-10,12H2,(H,24,26)/t18-/m0/s1