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

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(3-bromanyl-5-fluoranyl-phenyl)methyl]piperidine Openeye Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(3-bromo-5-fluoro-phenyl)methyl]piperidine CAS Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(3-bromo-5-fluorophenyl)methyl]piperidine IUPAC Name: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(3-bromo-5-fluorophenyl)methyl]piperidine Traditional Name: 4-(3-bromo-5-fluoro-benzyl)-1-homopiperonyl-piperidine Formula: C21H23BrFNO2 MolecularWeight: 420.315223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC(=CC(=C2)Br)F)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCC1CC2=CC(=CC(=C2)Br)F)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H23BrFNO2/c22-18-10-17(11-19(23)13-18)9-16-4-7-24(8-5-16)6-3-15-1-2-20-21(12-15)26-14-25-20/h1-2,10-13,16H,3-9,14H2