6-ethyl-2-[5-(2-fluorophenyl)furan-2-yl]quinoline-4-carboxylic acid

Systemtic Name: 6-ethyl-2-[5-(2-fluorophenyl)furan-2-yl]quinoline-4-carboxylic acid Openeye Name: 6-ethyl-2-[5-(2-fluorophenyl)-2-furyl]quinoline-4-carboxylic acid CAS Name: 6-ethyl-2-[5-(2-fluorophenyl)-2-furanyl]-4-quinolinecarboxylic acid IUPAC Name: 6-ethyl-2-[5-(2-fluorophenyl)furan-2-yl]quinoline-4-carboxylic acid Traditional Name: 6-ethyl-2-[5-(2-fluorophenyl)-2-furyl]cinchoninic acid Formula: C22H16FNO3 MolecularWeight: 361.365743

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=C(O3)C4=CC=CC=C4F

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC=C(O3)C4=CC=CC=C4F

InChI

InChI=1S/C22H16FNO3/c1-2-13-7-8-18-15(11-13)16(22(25)26)12-19(24-18)21-10-9-20(27-21)14-5-3-4-6-17(14)23/h3-12H,2H2,1H3,(H,25,26)