5-[3-ethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]-2-methylsulfonyl-pyridine

Systemtic Name: 5-[3-ethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]-2-methylsulfonyl-pyridine Openeye Name: 5-[3-ethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]-2-methylsulfonyl-pyridine CAS Name: 5-[3-ethyl-5-[4-(trifluoromethyl)phenyl]-1-cyclopenta-1,4-dienyl]-2-methylsulfonylpyridine IUPAC Name: 5-[3-ethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]-2-methylsulfonylpyridine Traditional Name: 5-[3-ethyl-5-[4-(trifluoromethyl)phenyl]cyclopenta-1,4-dien-1-yl]-2-mesyl-pyridine Formula: C20H18F3NO2S MolecularWeight: 393.42263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C=C(C(=C1)C2=CN=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCC1C=C(C(=C1)C2=CN=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H18F3NO2S/c1-3-13-10-17(14-4-7-16(8-5-14)20(21,22)23)18(11-13)15-6-9-19(24-12-15)27(2,25)26/h4-13H,3H2,1-2H3