2-methyl-2-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenoxy]propanoic acid Openeye Name: 2-methyl-2-[4-[4-(2-pyridyl)piperazin-1-yl]sulfonylphenoxy]propanoic acid CAS Name: 2-methyl-2-[4-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenoxy]propanoic acid Traditional Name: 2-methyl-2-[4-[4-(2-pyridyl)piperazino]sulfonylphenoxy]propionic acid Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C19H23N3O5S/c1-19(2,18(23)24)27-15-6-8-16(9-7-15)28(25,26)22-13-11-21(12-14-22)17-5-3-4-10-20-17/h3-10H,11-14H2,1-2H3,(H,23,24)