2-(4-bromanylphenoxy)-1-[4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanylphenoxy)-1-[4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-(4-bromophenoxy)-1-[4-[(2,4-dimethoxy-3-methyl-phenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(4-bromophenoxy)-1-[4-[(2,4-dimethoxy-3-methylphenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromophenoxy)-1-[4-[(2,4-dimethoxy-3-methylphenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(4-bromophenoxy)-1-[4-(2,4-dimethoxy-3-methyl-benzyl)piperazino]ethanone Formula: C22H27BrN2O4 MolecularWeight: 463.36478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)CN2CCN(CC2)C(=O)COC3=CC=C(C=C3)Br)OC

Isomeric SMILES

CC1=C(C=CC(=C1OC)CN2CCN(CC2)C(=O)COC3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C22H27BrN2O4/c1-16-20(27-2)9-4-17(22(16)28-3)14-24-10-12-25(13-11-24)21(26)15-29-19-7-5-18(23)6-8-19/h4-9H,10-15H2,1-3H3