methyl 6-fluoranyl-2-(6-fluoranyl-4-phenyl-benzimidazol-1-yl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: methyl 6-fluoranyl-2-(6-fluoranyl-4-phenyl-benzimidazol-1-yl)-3-methyl-quinoline-4-carboxylate Openeye Name: methyl 6-fluoro-2-(6-fluoro-4-phenyl-benzimidazol-1-yl)-3-methyl-quinoline-4-carboxylate CAS Name: 6-fluoro-2-(6-fluoro-4-phenyl-1-benzimidazolyl)-3-methyl-4-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 6-fluoro-2-(6-fluoro-4-phenylbenzimidazol-1-yl)-3-methylquinoline-4-carboxylate Traditional Name: 6-fluoro-2-(6-fluoro-4-phenyl-benzimidazol-1-yl)-3-methyl-cinchoninic acid methyl ester Formula: C25H17F2N3O2 MolecularWeight: 429.418186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC(=CC2=C1C(=O)OC)F)N3C=NC4=C3C=C(C=C4C5=CC=CC=C5)F

Isomeric SMILES

CC1=C(N=C2C=CC(=CC2=C1C(=O)OC)F)N3C=NC4=C3C=C(C=C4C5=CC=CC=C5)F

InChI

InChI=1S/C25H17F2N3O2/c1-14-22(25(31)32-2)19-10-16(26)8-9-20(19)29-24(14)30-13-28-23-18(11-17(27)12-21(23)30)15-6-4-3-5-7-15/h3-13H,1-2H3