4-(5-methylsulfonylthiophen-3-yl)-7-[4-(trifluoromethyl)phenyl]naphthalene-2-carboxylic acid

Systemtic Name: 4-(5-methylsulfonylthiophen-3-yl)-7-[4-(trifluoromethyl)phenyl]naphthalene-2-carboxylic acid Openeye Name: 4-(5-methylsulfonyl-3-thienyl)-7-[4-(trifluoromethyl)phenyl]naphthalene-2-carboxylic acid CAS Name: 4-(5-methylsulfonyl-3-thiophenyl)-7-[4-(trifluoromethyl)phenyl]-2-naphthalenecarboxylic acid IUPAC Name: 4-(5-methylsulfonylthiophen-3-yl)-7-[4-(trifluoromethyl)phenyl]naphthalene-2-carboxylic acid Traditional Name: 4-(5-mesyl-3-thienyl)-7-[4-(trifluoromethyl)phenyl]-2-naphthoic acid Formula: C23H15F3O4S2 MolecularWeight: 476.48801

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CS1)C2=C3C=CC(=CC3=CC(=C2)C(=O)O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC(=CS1)C2=C3C=CC(=CC3=CC(=C2)C(=O)O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H15F3O4S2/c1-32(29,30)21-11-17(12-31-21)20-10-16(22(27)28)9-15-8-14(4-7-19(15)20)13-2-5-18(6-3-13)23(24,25)26/h2-12H,1H3,(H,27,28)