2-[4-[4-[phenethyl(piperidin-4-yl)amino]piperidin-1-yl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[4-[phenethyl(piperidin-4-yl)amino]piperidin-1-yl]phenoxy]ethanoic acid Openeye Name: 2-[4-[4-[phenethyl(4-piperidyl)amino]-1-piperidyl]phenoxy]acetic acid CAS Name: 2-[4-[4-[phenethyl(4-piperidinyl)amino]-1-piperidinyl]phenoxy]acetic acid IUPAC Name: 2-[4-[4-[phenethyl(piperidin-4-yl)amino]piperidin-1-yl]phenoxy]acetic acid Traditional Name: 2-[4-[4-[phenethyl(4-piperidyl)amino]piperidino]phenoxy]acetic acid Formula: C26H35N3O3 MolecularWeight: 437.5744

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CCC2=CC=CC=C2)C3CCN(CC3)C4=CC=C(C=C4)OCC(=O)O

Isomeric SMILES

C1CNCCC1N(CCC2=CC=CC=C2)C3CCN(CC3)C4=CC=C(C=C4)OCC(=O)O

InChI

InChI=1S/C26H35N3O3/c30-26(31)20-32-25-8-6-22(7-9-25)28-17-13-24(14-18-28)29(23-10-15-27-16-11-23)19-12-21-4-2-1-3-5-21/h1-9,23-24,27H,10-20H2,(H,30,31)