2-[4-[2-(2-oxidanylidene-4-pyridin-4-yl-piperazin-1-yl)propanoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-(2-oxidanylidene-4-pyridin-4-yl-piperazin-1-yl)propanoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[2-oxo-4-(4-pyridyl)piperazin-1-yl]propanoyl]phenoxy]acetic acid CAS Name: 2-[4-[1-oxo-2-(2-oxo-4-pyridin-4-yl-1-piperazinyl)propyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-(2-oxo-4-pyridin-4-ylpiperazin-1-yl)propanoyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[2-keto-4-(4-pyridyl)piperazino]propanoyl]phenoxy]acetic acid Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)OCC(=O)O)N2CCN(CC2=O)C3=CC=NC=C3

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)OCC(=O)O)N2CCN(CC2=O)C3=CC=NC=C3

InChI

InChI=1S/C20H21N3O5/c1-14(20(27)15-2-4-17(5-3-15)28-13-19(25)26)23-11-10-22(12-18(23)24)16-6-8-21-9-7-16/h2-9,14H,10-13H2,1H3,(H,25,26)