4-[3,3-diethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]benzenesulfonamide

Systemtic Name: 4-[3,3-diethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]benzenesulfonamide Openeye Name: 4-[3,3-diethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]benzenesulfonamide CAS Name: 4-[3,3-diethyl-5-[4-(trifluoromethyl)phenyl]-1-cyclopenta-1,4-dienyl]benzenesulfonamide IUPAC Name: 4-[3,3-diethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]benzenesulfonamide Traditional Name: 4-[3,3-diethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]benzenesulfonamide Formula: C22H22F3NO2S MolecularWeight: 421.47579

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=C(C(=C1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=C(C=C3)C(F)(F)F)CC

Isomeric SMILES

CCC1(C=C(C(=C1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=C(C=C3)C(F)(F)F)CC

InChI

InChI=1S/C22H22F3NO2S/c1-3-21(4-2)13-19(15-5-9-17(10-6-15)22(23,24)25)20(14-21)16-7-11-18(12-8-16)29(26,27)28/h5-14H,3-4H2,1-2H3,(H2,26,27,28)