2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(3,4,5-trimethoxyphenyl)acetamide CAS Name: 2-[4-[(3-bromophenyl)methyl]-1-piperazinyl]-N-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: 2-[4-(3-bromobenzyl)piperazino]-N-(3,4,5-trimethoxyphenyl)acetamide Formula: C22H28BrN3O4 MolecularWeight: 478.37942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)CN2CCN(CC2)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H28BrN3O4/c1-28-19-12-18(13-20(29-2)22(19)30-3)24-21(27)15-26-9-7-25(8-10-26)14-16-5-4-6-17(23)11-16/h4-6,11-13H,7-10,14-15H2,1-3H3,(H,24,27)