6-fluoranyl-3-methyl-2-[2-(4-nitrophenoxy)phenyl]quinoline-4-carboxylic acid

Systemtic Name: 6-fluoranyl-3-methyl-2-[2-(4-nitrophenoxy)phenyl]quinoline-4-carboxylic acid Openeye Name: 6-fluoro-3-methyl-2-[2-(4-nitrophenoxy)phenyl]quinoline-4-carboxylic acid CAS Name: 6-fluoro-3-methyl-2-[2-(4-nitrophenoxy)phenyl]-4-quinolinecarboxylic acid IUPAC Name: 6-fluoro-3-methyl-2-[2-(4-nitrophenoxy)phenyl]quinoline-4-carboxylic acid Traditional Name: 6-fluoro-3-methyl-2-[2-(4-nitrophenoxy)phenyl]cinchoninic acid Formula: C23H15FN2O5 MolecularWeight: 418.374003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)O)F)C3=CC=CC=C3OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)O)F)C3=CC=CC=C3OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H15FN2O5/c1-13-21(23(27)28)18-12-14(24)6-11-19(18)25-22(13)17-4-2-3-5-20(17)31-16-9-7-15(8-10-16)26(29)30/h2-12H,1H3,(H,27,28)