3-azanyl-2-[4-[2,4-bis(fluoranyl)phenyl]phenyl]quinoline-4-carboxylic acid

Systemtic Name: 3-azanyl-2-[4-[2,4-bis(fluoranyl)phenyl]phenyl]quinoline-4-carboxylic acid Openeye Name: 3-amino-2-[4-(2,4-difluorophenyl)phenyl]quinoline-4-carboxylic acid CAS Name: 3-amino-2-[4-(2,4-difluorophenyl)phenyl]-4-quinolinecarboxylic acid IUPAC Name: 3-amino-2-[4-(2,4-difluorophenyl)phenyl]quinoline-4-carboxylic acid Traditional Name: 3-amino-2-[4-(2,4-difluorophenyl)phenyl]cinchoninic acid Formula: C22H14F2N2O2 MolecularWeight: 376.355566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)C4=C(C=C(C=C4)F)F)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)C4=C(C=C(C=C4)F)F)N)C(=O)O

InChI

InChI=1S/C22H14F2N2O2/c23-14-9-10-15(17(24)11-14)12-5-7-13(8-6-12)21-20(25)19(22(27)28)16-3-1-2-4-18(16)26-21/h1-11H,25H2,(H,27,28)