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2-[3-[1-(2-methylphenyl)sulfonylpiperidin-3-yl]phenyl]ethanoic acid

2-[3-[1-(2-methylphenyl)sulfonylpiperidin-3-yl]phenyl]ethanoic acid

Systemtic Name:2-[3-[1-(2-methylphenyl)sulfonylpiperidin-3-yl]phenyl]ethanoic acid
Openeye Name:2-[3-[1-(o-tolylsulfonyl)-3-piperidyl]phenyl]acetic acid
CAS Name:2-[3-[1-(2-methylphenyl)sulfonyl-3-piperidinyl]phenyl]acetic acid
IUPAC Name:2-[3-[1-(2-methylphenyl)sulfonylpiperidin-3-yl]phenyl]acetic acid
Traditional Name:2-[3-[1-(o-tolylsulfonyl)-3-piperidyl]phenyl]acetic acid
Formula: C20H23NO4S
MolecularWeight: 373.46592
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)N2CCCC(C2)C3=CC(=CC=C3)CC(=O)O


Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)N2CCCC(C2)C3=CC(=CC=C3)CC(=O)O


InChI

InChI=1S/C20H23NO4S/c1-15-6-2-3-10-19(15)26(24,25)21-11-5-9-18(14-21)17-8-4-7-16(12-17)13-20(22)23/h2-4,6-8,10,12,18H,5,9,11,13-14H2,1H3,(H,22,23)


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