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

Systemtic Name: 2-methyl-2-[4-(4-phenylpiperazin-1-yl)sulfonylphenoxy]propanoic acid Openeye Name: 2-methyl-2-[4-(4-phenylpiperazin-1-yl)sulfonylphenoxy]propanoic acid CAS Name: 2-methyl-2-[4-[(4-phenyl-1-piperazinyl)sulfonyl]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[4-(4-phenylpiperazin-1-yl)sulfonylphenoxy]propanoic acid Traditional Name: 2-methyl-2-[4-(4-phenylpiperazino)sulfonylphenoxy]propionic acid Formula: C20H24N2O5S MolecularWeight: 404.47996

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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=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O5S/c1-20(2,19(23)24)27-17-8-10-18(11-9-17)28(25,26)22-14-12-21(13-15-22)16-6-4-3-5-7-16/h3-11H,12-15H2,1-2H3,(H,23,24)