1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(3-bromanyl-5-ethoxy-phenyl)methyl]piperidine

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(3-bromanyl-5-ethoxy-phenyl)methyl]piperidine Openeye Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(3-bromo-5-ethoxy-phenyl)methyl]piperidine CAS Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(3-bromo-5-ethoxyphenyl)methyl]piperidine IUPAC Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(3-bromo-5-ethoxyphenyl)methyl]piperidine Traditional Name: 4-(3-bromo-5-ethoxy-benzyl)-1-homopiperonyl-piperidine Formula: C23H28BrNO3 MolecularWeight: 446.37732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)CC2CCN(CC2)CCC3=CC4=C(C=C3)OCO4)Br

Isomeric SMILES

CCOC1=CC(=CC(=C1)CC2CCN(CC2)CCC3=CC4=C(C=C3)OCO4)Br

InChI

InChI=1S/C23H28BrNO3/c1-2-26-21-13-19(12-20(24)15-21)11-18-6-9-25(10-7-18)8-5-17-3-4-22-23(14-17)28-16-27-22/h3-4,12-15,18H,2,5-11,16H2,1H3