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

Systemtic Name: N-(2-fluoranyl-5-methyl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(2-fluoro-5-methyl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-(2-fluoro-5-methylphenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(2-fluoro-5-methylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(2-fluoro-5-methyl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C16H16FNO4S MolecularWeight: 337.365943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC(=C(C=C1)F)NS(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H16FNO4S/c1-11-3-5-13(17)14(9-11)18-23(19,20)12-4-6-15-16(10-12)22-8-2-7-21-15/h3-6,9-10,18H,2,7-8H2,1H3