6-chloranyl-N-[[2-(trifluoromethyloxy)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[[2-(trifluoromethyloxy)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[[2-(trifluoromethoxy)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[[2-(trifluoromethoxy)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[[2-(trifluoromethoxy)phenyl]methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[2-(trifluoromethoxy)benzyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C18H15ClF3NO4 MolecularWeight: 401.76421

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)NCC3=CC=CC=C3OC(F)(F)F)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)NCC3=CC=CC=C3OC(F)(F)F)Cl)OC1

InChI

InChI=1S/C18H15ClF3NO4/c19-13-8-12(9-15-16(13)26-7-3-6-25-15)17(24)23-10-11-4-1-2-5-14(11)27-18(20,21)22/h1-2,4-5,8-9H,3,6-7,10H2,(H,23,24)