2-[3-(4-pyridin-3-ylcarbonylpiperazin-1-yl)phenoxy]ethanoic acid

Systemtic Name: 2-[3-(4-pyridin-3-ylcarbonylpiperazin-1-yl)phenoxy]ethanoic acid Openeye Name: 2-[3-[4-(pyridine-3-carbonyl)piperazin-1-yl]phenoxy]acetic acid CAS Name: 2-[3-[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]phenoxy]acetic acid IUPAC Name: 2-[3-[4-(pyridine-3-carbonyl)piperazin-1-yl]phenoxy]acetic acid Traditional Name: 2-[3-(4-nicotinoylpiperazino)phenoxy]acetic acid Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)OCC(=O)O)C(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)OCC(=O)O)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H19N3O4/c22-17(23)13-25-16-5-1-4-15(11-16)20-7-9-21(10-8-20)18(24)14-3-2-6-19-12-14/h1-6,11-12H,7-10,13H2,(H,22,23)