2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]ethanamide Openeye Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: 2-[4-[(3-bromophenyl)methyl]-1-piperazinyl]-N-[(4-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide Traditional Name: 2-[4-(3-bromobenzyl)piperazino]-N-p-anisyl-acetamide Formula: C21H26BrN3O2 MolecularWeight: 432.35404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H26BrN3O2/c1-27-20-7-5-17(6-8-20)14-23-21(26)16-25-11-9-24(10-12-25)15-18-3-2-4-19(22)13-18/h2-8,13H,9-12,14-16H2,1H3,(H,23,26)