N-(2-adamantyl)-3,5-bis(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-(2-adamantyl)-3,5-bis(trifluoromethyl)benzenesulfonamide Openeye Name: N-(2-adamantyl)-3,5-bis(trifluoromethyl)benzenesulfonamide CAS Name: N-(2-adamantyl)-3,5-bis(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(2-adamantyl)-3,5-bis(trifluoromethyl)benzenesulfonamide Traditional Name: N-(2-adamantyl)-3,5-bis(trifluoromethyl)benzenesulfonamide Formula: C18H19F6NO2S MolecularWeight: 427.404379

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NS(=O)(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NS(=O)(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H19F6NO2S/c19-17(20,21)13-6-14(18(22,23)24)8-15(7-13)28(26,27)25-16-11-2-9-1-10(4-11)5-12(16)3-9/h6-12,16,25H,1-5H2