N-[[2,4-bis(fluoranyl)phenyl]methyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[[2,4-bis(fluoranyl)phenyl]methyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[(2,4-difluorophenyl)methyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[(2,4-difluorophenyl)methyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[(2,4-difluorophenyl)methyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(2,4-difluorobenzyl)-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C17H17F2NO4S MolecularWeight: 369.382986

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=C(C=C1)F)F)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN(CC1=C(C=C(C=C1)F)F)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H17F2NO4S/c1-20(11-12-3-4-13(18)9-15(12)19)25(21,22)14-5-6-16-17(10-14)24-8-2-7-23-16/h3-6,9-10H,2,7-8,11H2,1H3