2-[3,5-bis(trifluoromethyl)phenyl]carbonyl-6,8-bis(chloranyl)quinoline-4-carboxylic acid

Systemtic Name: 2-[3,5-bis(trifluoromethyl)phenyl]carbonyl-6,8-bis(chloranyl)quinoline-4-carboxylic acid Openeye Name: 2-[3,5-bis(trifluoromethyl)benzoyl]-6,8-dichloro-quinoline-4-carboxylic acid CAS Name: 2-[[3,5-bis(trifluoromethyl)phenyl]-oxomethyl]-6,8-dichloro-4-quinolinecarboxylic acid IUPAC Name: 2-[3,5-bis(trifluoromethyl)benzoyl]-6,8-dichloroquinoline-4-carboxylic acid Traditional Name: 2-[3,5-bis(trifluoromethyl)benzoyl]-6,8-dichloro-cinchoninic acid Formula: C19H7Cl2F6NO3 MolecularWeight: 482.160199

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)Cl

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)C2=NC3=C(C=C(C=C3C(=C2)C(=O)O)Cl)Cl

InChI

InChI=1S/C19H7Cl2F6NO3/c20-10-4-11-12(17(30)31)6-14(28-15(11)13(21)5-10)16(29)7-1-8(18(22,23)24)3-9(2-7)19(25,26)27/h1-6H,(H,30,31)