2-[(3-phenoxyphenyl)methyl]-N-(phenylmethyl)-1-azabicyclo[2.2.2]octan-3-amine

Systemtic Name: 2-[(3-phenoxyphenyl)methyl]-N-(phenylmethyl)-1-azabicyclo[2.2.2]octan-3-amine Openeye Name: N-benzyl-2-[(3-phenoxyphenyl)methyl]quinuclidin-3-amine CAS Name: 2-[(3-phenoxyphenyl)methyl]-N-(phenylmethyl)-1-azabicyclo[2.2.2]octan-3-amine IUPAC Name: N-benzyl-2-[(3-phenoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine Traditional Name: benzyl-[2-(3-phenoxybenzyl)quinuclidin-3-yl]amine Formula: C27H30N2O MolecularWeight: 398.5399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2CC3=CC(=CC=C3)OC4=CC=CC=C4)NCC5=CC=CC=C5

Isomeric SMILES

C1CN2CCC1C(C2CC3=CC(=CC=C3)OC4=CC=CC=C4)NCC5=CC=CC=C5

InChI

InChI=1S/C27H30N2O/c1-3-8-21(9-4-1)20-28-27-23-14-16-29(17-15-23)26(27)19-22-10-7-13-25(18-22)30-24-11-5-2-6-12-24/h1-13,18,23,26-28H,14-17,19-20H2