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

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperazinyl]-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-(4-benzylpiperazino)-N-(2,4,5-trimethoxybenzyl)acetamide Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)CN2CCN(CC2)CC3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)CN2CCN(CC2)CC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C23H31N3O4/c1-28-20-14-22(30-3)21(29-2)13-19(20)15-24-23(27)17-26-11-9-25(10-12-26)16-18-7-5-4-6-8-18/h4-8,13-14H,9-12,15-17H2,1-3H3,(H,24,27)