N-[(3,5-dimethoxyphenyl)methyl]-2-[3-oxidanylidene-1-(phenylmethyl)piperazin-2-yl]ethanamide

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-2-[3-oxidanylidene-1-(phenylmethyl)piperazin-2-yl]ethanamide Openeye Name: 2-(1-benzyl-3-oxo-piperazin-2-yl)-N-[(3,5-dimethoxyphenyl)methyl]acetamide CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-2-[3-oxo-1-(phenylmethyl)-2-piperazinyl]acetamide IUPAC Name: 2-(1-benzyl-3-oxopiperazin-2-yl)-N-[(3,5-dimethoxyphenyl)methyl]acetamide Traditional Name: 2-(1-benzyl-3-keto-piperazin-2-yl)-N-(3,5-dimethoxybenzyl)acetamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC(=O)CC2C(=O)NCCN2CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC(=O)CC2C(=O)NCCN2CC3=CC=CC=C3)OC

InChI

InChI=1S/C22H27N3O4/c1-28-18-10-17(11-19(12-18)29-2)14-24-21(26)13-20-22(27)23-8-9-25(20)15-16-6-4-3-5-7-16/h3-7,10-12,20H,8-9,13-15H2,1-2H3,(H,23,27)(H,24,26)