3-oxidanyl-2-(1-thiophen-2-ylcyclopropyl)-8-(trifluoromethyl)quinoline-4-carboxylic acid

Systemtic Name: 3-oxidanyl-2-(1-thiophen-2-ylcyclopropyl)-8-(trifluoromethyl)quinoline-4-carboxylic acid Openeye Name: 3-hydroxy-2-[1-(2-thienyl)cyclopropyl]-8-(trifluoromethyl)quinoline-4-carboxylic acid CAS Name: 3-hydroxy-2-(1-thiophen-2-ylcyclopropyl)-8-(trifluoromethyl)-4-quinolinecarboxylic acid IUPAC Name: 3-hydroxy-2-(1-thiophen-2-ylcyclopropyl)-8-(trifluoromethyl)quinoline-4-carboxylic acid Traditional Name: 3-hydroxy-2-[1-(2-thienyl)cyclopropyl]-8-(trifluoromethyl)cinchoninic acid Formula: C18H12F3NO3S MolecularWeight: 379.35299

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC=CS2)C3=C(C(=C4C=CC=C(C4=N3)C(F)(F)F)C(=O)O)O

Isomeric SMILES

C1CC1(C2=CC=CS2)C3=C(C(=C4C=CC=C(C4=N3)C(F)(F)F)C(=O)O)O

InChI

InChI=1S/C18H12F3NO3S/c19-18(20,21)10-4-1-3-9-12(16(24)25)14(23)15(22-13(9)10)17(6-7-17)11-5-2-8-26-11/h1-5,8,23H,6-7H2,(H,24,25)