2-[(4-bromophenyl)methyl-methyl-amino]-1-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-[(4-bromophenyl)methyl-methyl-amino]-1-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-[(4-bromophenyl)methyl-methyl-amino]-1-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-[(4-bromophenyl)methyl-methylamino]-1-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[(4-bromophenyl)methyl-methylamino]-1-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-[(4-bromobenzyl)-methyl-amino]-1-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazino]ethanone Formula: C24H32BrN3O3 MolecularWeight: 490.43318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CCN(CC2)C(=O)CN(C)CC3=CC=C(C=C3)Br)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CCN(CC2)C(=O)CN(C)CC3=CC=C(C=C3)Br)OC)OC

InChI

InChI=1S/C24H32BrN3O3/c1-18-13-22(30-3)23(31-4)14-20(18)16-27-9-11-28(12-10-27)24(29)17-26(2)15-19-5-7-21(25)8-6-19/h5-8,13-14H,9-12,15-17H2,1-4H3