4-[(3-bromanyl-5-methoxy-phenyl)methyl]-1-[2-(6-chloranyl-1,3-benzodioxol-5-yl)ethyl]piperidine

Systemtic Name: 4-[(3-bromanyl-5-methoxy-phenyl)methyl]-1-[2-(6-chloranyl-1,3-benzodioxol-5-yl)ethyl]piperidine Openeye Name: 4-[(3-bromo-5-methoxy-phenyl)methyl]-1-[2-(6-chloro-1,3-benzodioxol-5-yl)ethyl]piperidine CAS Name: 4-[(3-bromo-5-methoxyphenyl)methyl]-1-[2-(6-chloro-1,3-benzodioxol-5-yl)ethyl]piperidine IUPAC Name: 4-[(3-bromo-5-methoxyphenyl)methyl]-1-[2-(6-chloro-1,3-benzodioxol-5-yl)ethyl]piperidine Traditional Name: 4-(3-bromo-5-methoxy-benzyl)-1-[2-(6-chloro-1,3-benzodioxol-5-yl)ethyl]piperidine Formula: C22H25BrClNO3 MolecularWeight: 466.7958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CC2CCN(CC2)CCC3=CC4=C(C=C3Cl)OCO4)Br

Isomeric SMILES

COC1=CC(=CC(=C1)CC2CCN(CC2)CCC3=CC4=C(C=C3Cl)OCO4)Br

InChI

InChI=1S/C22H25BrClNO3/c1-26-19-10-16(9-18(23)12-19)8-15-2-5-25(6-3-15)7-4-17-11-21-22(13-20(17)24)28-14-27-21/h9-13,15H,2-8,14H2,1H3