N-cyclopropyl-N-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-cyclopropyl-N-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-cyclopropyl-N-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-cyclopropyl-N-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-cyclopropyl-N-[[4-(trifluoromethyl)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-cyclopropyl-N-[4-(trifluoromethyl)benzyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C21H20F3NO3 MolecularWeight: 391.38361

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)N(CC3=CC=C(C=C3)C(F)(F)F)C4CC4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)N(CC3=CC=C(C=C3)C(F)(F)F)C4CC4)OC1

InChI

InChI=1S/C21H20F3NO3/c22-21(23,24)16-5-2-14(3-6-16)13-25(17-7-8-17)20(26)15-4-9-18-19(12-15)28-11-1-10-27-18/h2-6,9,12,17H,1,7-8,10-11,13H2