2-[1-(4-chlorophenyl)cyclopropyl]-3-oxidanyl-6-(trifluoromethyl)quinoline-4-carboxylic acid

Systemtic Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-oxidanyl-6-(trifluoromethyl)quinoline-4-carboxylic acid Openeye Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-hydroxy-6-(trifluoromethyl)quinoline-4-carboxylic acid CAS Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-hydroxy-6-(trifluoromethyl)-4-quinolinecarboxylic acid IUPAC Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-hydroxy-6-(trifluoromethyl)quinoline-4-carboxylic acid Traditional Name: 2-[1-(4-chlorophenyl)cyclopropyl]-3-hydroxy-6-(trifluoromethyl)cinchoninic acid Formula: C20H13ClF3NO3 MolecularWeight: 407.77033

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC=C(C=C2)Cl)C3=C(C(=C4C=C(C=CC4=N3)C(F)(F)F)C(=O)O)O

Isomeric SMILES

C1CC1(C2=CC=C(C=C2)Cl)C3=C(C(=C4C=C(C=CC4=N3)C(F)(F)F)C(=O)O)O

InChI

InChI=1S/C20H13ClF3NO3/c21-12-4-1-10(2-5-12)19(7-8-19)17-16(26)15(18(27)28)13-9-11(20(22,23)24)3-6-14(13)25-17/h1-6,9,26H,7-8H2,(H,27,28)