ethyl 1-[1-[2,4-bis(fluoranyl)phenyl]-2-methyl-benzimidazol-5-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-[2,4-bis(fluoranyl)phenyl]-2-methyl-benzimidazol-5-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-(2,4-difluorophenyl)-2-methyl-benzimidazole-5-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-(2,4-difluorophenyl)-2-methyl-5-benzimidazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(2,4-difluorophenyl)-2-methylbenzimidazole-5-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(2,4-difluorophenyl)-2-methyl-benzimidazole-5-carbonyl]isonipecotic acid ethyl ester Formula: C23H23F2N3O3 MolecularWeight: 427.443826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC3=C(C=C2)N(C(=N3)C)C4=C(C=C(C=C4)F)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC3=C(C=C2)N(C(=N3)C)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C23H23F2N3O3/c1-3-31-23(30)15-8-10-27(11-9-15)22(29)16-4-6-21-19(12-16)26-14(2)28(21)20-7-5-17(24)13-18(20)25/h4-7,12-13,15H,3,8-11H2,1-2H3