1-[(3R,4R)-1-(3,3-dimethylbutyl)-3-(hydroxymethyl)piperidin-4-yl]-3-ethyl-benzimidazol-2-one

Systemtic Name: 1-[(3R,4R)-1-(3,3-dimethylbutyl)-3-(hydroxymethyl)piperidin-4-yl]-3-ethyl-benzimidazol-2-one Openeye Name: 1-[(3R,4R)-1-(3,3-dimethylbutyl)-3-(hydroxymethyl)-4-piperidyl]-3-ethyl-benzimidazol-2-one CAS Name: 1-[(3R,4R)-1-(3,3-dimethylbutyl)-3-(hydroxymethyl)-4-piperidinyl]-3-ethyl-2-benzimidazolone IUPAC Name: 1-[(3R,4R)-1-(3,3-dimethylbutyl)-3-(hydroxymethyl)piperidin-4-yl]-3-ethylbenzimidazol-2-one Traditional Name: 1-[(3R,4R)-1-(3,3-dimethylbutyl)-3-methylol-4-piperidyl]-3-ethyl-benzimidazol-2-one Formula: C21H33N3O2 MolecularWeight: 359.50562

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)C3CCN(CC3CO)CCC(C)(C)C

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)[C@@H]3CCN(C[C@H]3CO)CCC(C)(C)C

InChI

InChI=1S/C21H33N3O2/c1-5-23-18-8-6-7-9-19(18)24(20(23)26)17-10-12-22(14-16(17)15-25)13-11-21(2,3)4/h6-9,16-17,25H,5,10-15H2,1-4H3/t16-,17+/m0/s1