3-[4-[2-[phenyl-(3,4,5-trimethoxyphenyl)methoxy]ethyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[2-[phenyl-(3,4,5-trimethoxyphenyl)methoxy]ethyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[2-[phenyl-(3,4,5-trimethoxyphenyl)methoxy]ethyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[2-[phenyl-(3,4,5-trimethoxyphenyl)methoxy]ethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[2-[phenyl-(3,4,5-trimethoxyphenyl)methoxy]ethyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-[phenyl-(3,4,5-trimethoxyphenyl)methoxy]ethyl]piperazino]propionic acid Formula: C25H34N2O6 MolecularWeight: 458.54726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(C2=CC=CC=C2)OCCN3CCN(CC3)CCC(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(C2=CC=CC=C2)OCCN3CCN(CC3)CCC(=O)O

InChI

InChI=1S/C25H34N2O6/c1-30-21-17-20(18-22(31-2)25(21)32-3)24(19-7-5-4-6-8-19)33-16-15-27-13-11-26(12-14-27)10-9-23(28)29/h4-8,17-18,24H,9-16H2,1-3H3,(H,28,29)