4-bromanyl-N-[1-(4-tert-butylphenyl)carbonylpiperidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[1-(4-tert-butylphenyl)carbonylpiperidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: 4-bromo-N-[1-(4-tert-butylbenzoyl)-4-piperidyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: 4-bromo-N-[1-[(4-tert-butylphenyl)-oxomethyl]-4-piperidinyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: 4-bromo-N-[1-(4-tert-butylbenzoyl)piperidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: 4-bromo-N-[1-(4-tert-butylbenzoyl)-4-piperidyl]-2-(trifluoromethyl)benzenesulfonamide Formula: C23H26BrF3N2O3S MolecularWeight: 547.42835

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=C(C=C(C=C3)Br)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)NS(=O)(=O)C3=C(C=C(C=C3)Br)C(F)(F)F

InChI

InChI=1S/C23H26BrF3N2O3S/c1-22(2,3)16-6-4-15(5-7-16)21(30)29-12-10-18(11-13-29)28-33(31,32)20-9-8-17(24)14-19(20)23(25,26)27/h4-9,14,18,28H,10-13H2,1-3H3