5-[3,3-diethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-2-(trifluoromethyl)pyridine

Systemtic Name: 5-[3,3-diethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-2-(trifluoromethyl)pyridine Openeye Name: 5-[3,3-diethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-2-(trifluoromethyl)pyridine CAS Name: 5-[3,3-diethyl-5-(4-methylsulfonylphenyl)-1-cyclopenta-1,4-dienyl]-2-(trifluoromethyl)pyridine IUPAC Name: 5-[3,3-diethyl-5-(4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]-2-(trifluoromethyl)pyridine Traditional Name: 5-[3,3-diethyl-5-(4-mesylphenyl)cyclopenta-1,4-dien-1-yl]-2-(trifluoromethyl)pyridine Formula: C22H22F3NO2S MolecularWeight: 421.47579

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22F3NO2S/c1-4-21(5-2)12-18(15-6-9-17(10-7-15)29(3,27)28)19(13-21)16-8-11-20(26-14-16)22(23,24)25/h6-14H,4-5H2,1-3H3