ethyl 3-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-3-yl]propanoate

Systemtic Name: ethyl 3-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-3-yl]propanoate Openeye Name: ethyl 3-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxo-benzimidazol-1-yl)-3-piperidyl]propanoate CAS Name: 3-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxo-1-benzimidazolyl)-3-piperidinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[1-(cyclooctylmethyl)-4-(3-ethyl-2-oxobenzimidazol-1-yl)piperidin-3-yl]propanoate Traditional Name: 3-[1-(cyclooctylmethyl)-4-(3-ethyl-2-keto-benzimidazol-1-yl)-3-piperidyl]propionic acid ethyl ester Formula: C28H43N3O3 MolecularWeight: 469.65932

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)C3CCN(CC3CCC(=O)OCC)CC4CCCCCCC4

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)C3CCN(CC3CCC(=O)OCC)CC4CCCCCCC4

InChI

InChI=1S/C28H43N3O3/c1-3-30-25-14-10-11-15-26(25)31(28(30)33)24-18-19-29(20-22-12-8-6-5-7-9-13-22)21-23(24)16-17-27(32)34-4-2/h10-11,14-15,22-24H,3-9,12-13,16-21H2,1-2H3