N-[(5-butan-2-yl-2-methoxy-phenyl)methyl]-2-(diphenylmethyl)-1-azabicyclo[2.2.2]octan-3-amine

Systemtic Name: N-[(5-butan-2-yl-2-methoxy-phenyl)methyl]-2-(diphenylmethyl)-1-azabicyclo[2.2.2]octan-3-amine Openeye Name: 2-benzhydryl-N-[(2-methoxy-5-sec-butyl-phenyl)methyl]quinuclidin-3-amine CAS Name: N-[(5-butan-2-yl-2-methoxyphenyl)methyl]-2-(diphenylmethyl)-1-azabicyclo[2.2.2]octan-3-amine IUPAC Name: 2-benzhydryl-N-[(5-butan-2-yl-2-methoxyphenyl)methyl]-1-azabicyclo[2.2.2]octan-3-amine Traditional Name: (2-benzhydrylquinuclidin-3-yl)-(2-methoxy-5-sec-butyl-benzyl)amine Formula: C32H40N2O MolecularWeight: 468.6728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)OC)CNC2C3CCN(C2C(C4=CC=CC=C4)C5=CC=CC=C5)CC3

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)OC)CNC2C3CCN(C2C(C4=CC=CC=C4)C5=CC=CC=C5)CC3

InChI

InChI=1S/C32H40N2O/c1-4-23(2)27-15-16-29(35-3)28(21-27)22-33-31-26-17-19-34(20-18-26)32(31)30(24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-16,21,23,26,30-33H,4,17-20,22H2,1-3H3