3-[2-(1,3-benzodioxol-5-yl)ethyl]-7-[(diphenylmethyl)oxymethyl]-3-azabicyclo[2.2.1]heptane

Systemtic Name: 3-[2-(1,3-benzodioxol-5-yl)ethyl]-7-[(diphenylmethyl)oxymethyl]-3-azabicyclo[2.2.1]heptane Openeye Name: 7-(benzhydryloxymethyl)-3-[2-(1,3-benzodioxol-5-yl)ethyl]-3-azabicyclo[2.2.1]heptane CAS Name: 3-[2-(1,3-benzodioxol-5-yl)ethyl]-7-[(diphenylmethyl)oxymethyl]-3-azabicyclo[2.2.1]heptane IUPAC Name: 7-(benzhydryloxymethyl)-3-[2-(1,3-benzodioxol-5-yl)ethyl]-3-azabicyclo[2.2.1]heptane Traditional Name: 7-(benzhydryloxymethyl)-3-homopiperonyl-3-azabicyclo[2.2.1]heptane Formula: C29H31NO3 MolecularWeight: 441.56134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C1CN2CCC3=CC4=C(C=C3)OCO4)COC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CC2C(C1CN2CCC3=CC4=C(C=C3)OCO4)COC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H31NO3/c1-3-7-22(8-4-1)29(23-9-5-2-6-10-23)31-19-25-24-12-13-26(25)30(18-24)16-15-21-11-14-27-28(17-21)33-20-32-27/h1-11,14,17,24-26,29H,12-13,15-16,18-20H2