2-[1-(3-chlorophenyl)cyclopropyl]-3-oxidanyl-8-(trifluoromethyl)quinoline-4-carboxylic acid

Systemtic Name: 2-[1-(3-chlorophenyl)cyclopropyl]-3-oxidanyl-8-(trifluoromethyl)quinoline-4-carboxylic acid Openeye Name: 2-[1-(3-chlorophenyl)cyclopropyl]-3-hydroxy-8-(trifluoromethyl)quinoline-4-carboxylic acid CAS Name: 2-[1-(3-chlorophenyl)cyclopropyl]-3-hydroxy-8-(trifluoromethyl)-4-quinolinecarboxylic acid IUPAC Name: 2-[1-(3-chlorophenyl)cyclopropyl]-3-hydroxy-8-(trifluoromethyl)quinoline-4-carboxylic acid Traditional Name: 2-[1-(3-chlorophenyl)cyclopropyl]-3-hydroxy-8-(trifluoromethyl)cinchoninic acid Formula: C20H13ClF3NO3 MolecularWeight: 407.77033

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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