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

Systemtic Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-(3-oxidanylphenoxy)ethanone Openeye Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-(3-hydroxyphenoxy)ethanone CAS Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]-1-piperazinyl]-2-(3-hydroxyphenoxy)ethanone IUPAC Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazin-1-yl]-2-(3-hydroxyphenoxy)ethanone Traditional Name: 1-[4-[1-(3,4-dimethoxyphenyl)ethyl]piperazino]-2-(3-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=CC(=C3)O

Isomeric SMILES

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

InChI

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