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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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