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

Systemtic Name: 1-[1-(cyclooctylmethyl)-3,3-bis(hydroxymethyl)piperidin-4-yl]-3-ethyl-benzimidazol-2-one Openeye Name: 1-[1-(cyclooctylmethyl)-3,3-bis(hydroxymethyl)-4-piperidyl]-3-ethyl-benzimidazol-2-one CAS Name: 1-[1-(cyclooctylmethyl)-3,3-bis(hydroxymethyl)-4-piperidinyl]-3-ethyl-2-benzimidazolone IUPAC Name: 1-[1-(cyclooctylmethyl)-3,3-bis(hydroxymethyl)piperidin-4-yl]-3-ethylbenzimidazol-2-one Traditional Name: 1-[1-(cyclooctylmethyl)-3,3-dimethylol-4-piperidyl]-3-ethyl-benzimidazol-2-one Formula: C25H39N3O3 MolecularWeight: 429.59546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)C3CCN(CC3(CO)CO)CC4CCCCCCC4

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)C3CCN(CC3(CO)CO)CC4CCCCCCC4

InChI

InChI=1S/C25H39N3O3/c1-2-27-21-12-8-9-13-22(21)28(24(27)31)23-14-15-26(17-25(23,18-29)19-30)16-20-10-6-4-3-5-7-11-20/h8-9,12-13,20,23,29-30H,2-7,10-11,14-19H2,1H3