1-[4-(phenylmethyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenoxy)ethanone

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenoxy)ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(3,4,5-trimethoxyphenoxy)ethanone CAS Name: 1-[4-(phenylmethyl)-1-piperazinyl]-2-(3,4,5-trimethoxyphenoxy)ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(3,4,5-trimethoxyphenoxy)ethanone Traditional Name: 1-(4-benzylpiperazino)-2-(3,4,5-trimethoxyphenoxy)ethanone Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)OCC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)OCC(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O5/c1-26-19-13-18(14-20(27-2)22(19)28-3)29-16-21(25)24-11-9-23(10-12-24)15-17-7-5-4-6-8-17/h4-8,13-14H,9-12,15-16H2,1-3H3