ethyl 4-(cyclopropylmethyl)-1-[3-(6-fluoranyl-1H-benzimidazol-2-yl)propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-(cyclopropylmethyl)-1-[3-(6-fluoranyl-1H-benzimidazol-2-yl)propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 4-(cyclopropylmethyl)-1-[3-(6-fluoro-1H-benzimidazol-2-yl)propanoyl]piperidine-4-carboxylate CAS Name: 4-(cyclopropylmethyl)-1-[3-(6-fluoro-1H-benzimidazol-2-yl)-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cyclopropylmethyl)-1-[3-(6-fluoro-1H-benzimidazol-2-yl)propanoyl]piperidine-4-carboxylate Traditional Name: 4-(cyclopropylmethyl)-1-[3-(6-fluoro-1H-benzimidazol-2-yl)propanoyl]isonipecotic acid ethyl ester Formula: C22H28FN3O3 MolecularWeight: 401.474423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)CCC2=NC3=C(N2)C=C(C=C3)F)CC4CC4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)CCC2=NC3=C(N2)C=C(C=C3)F)CC4CC4

InChI

InChI=1S/C22H28FN3O3/c1-2-29-21(28)22(14-15-3-4-15)9-11-26(12-10-22)20(27)8-7-19-24-17-6-5-16(23)13-18(17)25-19/h5-6,13,15H,2-4,7-12,14H2,1H3,(H,24,25)