1-[[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-6-chloranyl-phenyl]methyl]piperidine

Systemtic Name: 1-[[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-6-chloranyl-phenyl]methyl]piperidine Openeye Name: 1-[[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-6-chloro-phenyl]methyl]piperidine CAS Name: 1-[[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-6-chlorophenyl]methyl]piperidine IUPAC Name: 1-[[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-6-chlorophenyl]methyl]piperidine Traditional Name: 1-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-6-chloro-benzyl]piperidine Formula: C21H25BrClNO MolecularWeight: 422.7863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CCC2=C(C(=CC=C2)Cl)CN3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CCC2=C(C(=CC=C2)Cl)CN3CCCCC3

InChI

InChI=1S/C21H25BrClNO/c1-25-21-11-10-18(22)14-17(21)9-8-16-6-5-7-20(23)19(16)15-24-12-3-2-4-13-24/h5-7,10-11,14H,2-4,8-9,12-13,15H2,1H3