2-(4-methoxyphenyl)sulfonyl-2-[phenyl(2-piperidin-1-ylethoxy)methyl]butanoic acid

Systemtic Name: 2-(4-methoxyphenyl)sulfonyl-2-[phenyl(2-piperidin-1-ylethoxy)methyl]butanoic acid Openeye Name: 2-(4-methoxyphenyl)sulfonyl-2-[phenyl-[2-(1-piperidyl)ethoxy]methyl]butanoic acid CAS Name: 2-(4-methoxyphenyl)sulfonyl-2-[phenyl-[2-(1-piperidinyl)ethoxy]methyl]butanoic acid IUPAC Name: 2-(4-methoxyphenyl)sulfonyl-2-[phenyl(2-piperidin-1-ylethoxy)methyl]butanoic acid Traditional Name: 2-(4-methoxyphenyl)sulfonyl-2-[phenyl(2-piperidinoethoxy)methyl]butyric acid Formula: C25H33NO6S MolecularWeight: 475.59762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)OCCN2CCCCC2)(C(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC(C(C1=CC=CC=C1)OCCN2CCCCC2)(C(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H33NO6S/c1-3-25(24(27)28,33(29,30)22-14-12-21(31-2)13-15-22)23(20-10-6-4-7-11-20)32-19-18-26-16-8-5-9-17-26/h4,6-7,10-15,23H,3,5,8-9,16-19H2,1-2H3,(H,27,28)