N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(pyridin-3-ylmethyl)piperazin-2-yl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(pyridin-3-ylmethyl)piperazin-2-yl]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(3-pyridylmethyl)piperazin-2-yl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(3-pyridinylmethyl)-2-piperazinyl]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(pyridin-3-ylmethyl)piperazin-2-yl]acetamide Traditional Name: N-homoveratryl-2-[4-(3-pyridylmethyl)piperazin-2-yl]acetamide Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CC2CN(CCN2)CC3=CN=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CC2CN(CCN2)CC3=CN=CC=C3)OC

InChI

InChI=1S/C22H30N4O3/c1-28-20-6-5-17(12-21(20)29-2)7-9-25-22(27)13-19-16-26(11-10-24-19)15-18-4-3-8-23-14-18/h3-6,8,12,14,19,24H,7,9-11,13,15-16H2,1-2H3,(H,25,27)