2-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonylphenyl]ethanoic acid

Systemtic Name: 2-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonylphenyl]ethanoic acid Openeye Name: 2-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonylphenyl]acetic acid CAS Name: 2-[3-[[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl]phenyl]acetic acid IUPAC Name: 2-[3-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonylphenyl]acetic acid Traditional Name: 2-[3-(4-o-phenetylpiperazino)sulfonylphenyl]acetic acid Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)CC(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)CC(=O)O

InChI

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