2-[4-[2-methyl-2-(4-pyridin-4-ylpiperazin-1-yl)propanoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-methyl-2-(4-pyridin-4-ylpiperazin-1-yl)propanoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-methyl-2-[4-(4-pyridyl)piperazin-1-yl]propanoyl]phenoxy]acetic acid CAS Name: 2-[4-[2-methyl-1-oxo-2-(4-pyridin-4-yl-1-piperazinyl)propyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-methyl-2-(4-pyridin-4-ylpiperazin-1-yl)propanoyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-methyl-2-[4-(4-pyridyl)piperazino]propanoyl]phenoxy]acetic acid Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4/c1-21(2,20(27)16-3-5-18(6-4-16)28-15-19(25)26)24-13-11-23(12-14-24)17-7-9-22-10-8-17/h3-10H,11-15H2,1-2H3,(H,25,26)