1-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-(4-oxidanylphenoxy)ethanone

Systemtic Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-(4-oxidanylphenoxy)ethanone Openeye Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-(4-hydroxyphenoxy)ethanone CAS Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]-1-piperazinyl]-2-(4-hydroxyphenoxy)ethanone IUPAC Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-(4-hydroxyphenoxy)ethanone Traditional Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazino]-2-(4-hydroxyphenoxy)ethanone Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)O

InChI

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