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

Systemtic Name: N-[(5-azanyl-2-methoxy-phenyl)methyl]-2-(diphenylmethyl)-1-azabicyclo[2.2.2]octan-2-amine Openeye Name: N-[(5-amino-2-methoxy-phenyl)methyl]-2-benzhydryl-quinuclidin-2-amine CAS Name: N-[(5-amino-2-methoxyphenyl)methyl]-2-(diphenylmethyl)-1-azabicyclo[2.2.2]octan-2-amine IUPAC Name: N-[(5-amino-2-methoxyphenyl)methyl]-2-benzhydryl-1-azabicyclo[2.2.2]octan-2-amine Traditional Name: (5-amino-2-methoxy-benzyl)-(2-benzhydrylquinuclidin-2-yl)amine Formula: C28H33N3O MolecularWeight: 427.58112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N)CNC2(CC3CCN2CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)N)CNC2(CC3CCN2CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H33N3O/c1-32-26-13-12-25(29)18-24(26)20-30-28(19-21-14-16-31(28)17-15-21)27(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-13,18,21,27,30H,14-17,19-20,29H2,1H3