(1R,4S,5R)-5-[2-[3-(1H-benzimidazol-2-yl)propyl-methyl-amino]ethyl]-2-(3-methylphenyl)bicyclo[2.2.2]oct-2-en-5-ol

Systemtic Name: (1R,4S,5R)-5-[2-[3-(1H-benzimidazol-2-yl)propyl-methyl-amino]ethyl]-2-(3-methylphenyl)bicyclo[2.2.2]oct-2-en-5-ol Openeye Name: (1R,4S,5R)-5-[2-[3-(1H-benzimidazol-2-yl)propyl-methyl-amino]ethyl]-2-(m-tolyl)bicyclo[2.2.2]oct-2-en-5-ol CAS Name: (1R,4S,5R)-5-[2-[3-(1H-benzimidazol-2-yl)propyl-methylamino]ethyl]-2-(3-methylphenyl)-5-bicyclo[2.2.2]oct-2-enol IUPAC Name: (1R,4S,5R)-5-[2-[3-(1H-benzimidazol-2-yl)propyl-methylamino]ethyl]-2-(3-methylphenyl)bicyclo[2.2.2]oct-2-en-5-ol Traditional Name: (1R,4S,5R)-5-[2-[3-(1H-benzimidazol-2-yl)propyl-methyl-amino]ethyl]-2-(m-tolyl)bicyclo[2.2.2]oct-2-en-5-ol Formula: C28H35N3O MolecularWeight: 429.597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC3CCC2CC3(CCN(C)CCCC4=NC5=CC=CC=C5N4)O

Isomeric SMILES

CC1=CC=CC(=C1)C2=C[C@@H]3CC[C@@H]2C[C@]3(CCN(C)CCCC4=NC5=CC=CC=C5N4)O

InChI

InChI=1S/C28H35N3O/c1-20-7-5-8-21(17-20)24-18-23-13-12-22(24)19-28(23,32)14-16-31(2)15-6-11-27-29-25-9-3-4-10-26(25)30-27/h3-5,7-10,17-18,22-23,32H,6,11-16,19H2,1-2H3,(H,29,30)/t22-,23+,28+/m1/s1