[2,5-bis(fluoranyl)-4-(4-octylsulfonylpiperazin-1-yl)phenyl] sulfamate

Systemtic Name: [2,5-bis(fluoranyl)-4-(4-octylsulfonylpiperazin-1-yl)phenyl] sulfamate Openeye Name: [2,5-difluoro-4-(4-octylsulfonylpiperazin-1-yl)phenyl] sulfamate CAS Name: sulfamic acid [2,5-difluoro-4-(4-octylsulfonyl-1-piperazinyl)phenyl] ester IUPAC Name: [2,5-difluoro-4-(4-octylsulfonylpiperazin-1-yl)phenyl] sulfamate Traditional Name: sulfamic acid [2,5-difluoro-4-(4-octylsulfonylpiperazino)phenyl] ester Formula: C18H29F2N3O5S2 MolecularWeight: 469.566766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2F)OS(=O)(=O)N)F

Isomeric SMILES

CCCCCCCCS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2F)OS(=O)(=O)N)F

InChI

InChI=1S/C18H29F2N3O5S2/c1-2-3-4-5-6-7-12-29(24,25)23-10-8-22(9-11-23)17-13-16(20)18(14-15(17)19)28-30(21,26)27/h13-14H,2-12H2,1H3,(H2,21,26,27)