2-chloranyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 2-chloranyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(trifluoromethyl)benzenesulfonamide Openeye Name: 2-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(trifluoromethyl)benzenesulfonamide CAS Name: 2-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(trifluoromethyl)benzenesulfonamide IUPAC Name: 2-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(trifluoromethyl)benzenesulfonamide Traditional Name: 2-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-(trifluoromethyl)benzenesulfonamide Formula: C16H13ClF3NO4S MolecularWeight: 407.79193

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)OC1

InChI

InChI=1S/C16H13ClF3NO4S/c17-12-4-2-10(16(18,19)20)8-15(12)26(22,23)21-11-3-5-13-14(9-11)25-7-1-6-24-13/h2-5,8-9,21H,1,6-7H2