ethyl 4-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]-1-piperidyl]-4-oxo-butanoate CAS Name: 4-[4-[(5,6-dimethyl-1-benzimidazolyl)methyl]-1-piperidinyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-yl]-4-oxobutanoate Traditional Name: 4-[4-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidino]-4-keto-butyric acid ethyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N1CCC(CC1)CN2C=NC3=C2C=C(C(=C3)C)C

Isomeric SMILES

CCOC(=O)CCC(=O)N1CCC(CC1)CN2C=NC3=C2C=C(C(=C3)C)C

InChI

InChI=1S/C21H29N3O3/c1-4-27-21(26)6-5-20(25)23-9-7-17(8-10-23)13-24-14-22-18-11-15(2)16(3)12-19(18)24/h11-12,14,17H,4-10,13H2,1-3H3