1-[[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-6-methyl-phenyl]methyl]-4-methyl-piperazine

Systemtic Name: 1-[[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-6-methyl-phenyl]methyl]-4-methyl-piperazine Openeye Name: 1-[[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-6-methyl-phenyl]methyl]-4-methyl-piperazine CAS Name: 1-[[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-6-methylphenyl]methyl]-4-methylpiperazine IUPAC Name: 1-[[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-6-methylphenyl]methyl]-4-methylpiperazine Traditional Name: 1-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-6-methyl-benzyl]-4-methyl-piperazine Formula: C22H29BrN2O MolecularWeight: 417.38246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CCC2=C(C=CC(=C2)Br)OC)CN3CCN(CC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)CCC2=C(C=CC(=C2)Br)OC)CN3CCN(CC3)C

InChI

InChI=1S/C22H29BrN2O/c1-17-5-4-6-18(21(17)16-25-13-11-24(2)12-14-25)7-8-19-15-20(23)9-10-22(19)26-3/h4-6,9-10,15H,7-8,11-14,16H2,1-3H3