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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=C(C=C1)OCCN2CCCCC2)(C(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC(CC1=CC=C(C=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)23-13-11-21(31-2)12-14-23)19-20-7-9-22(10-8-20)32-18-17-26-15-5-4-6-16-26/h7-14H,3-6,15-19H2,1-2H3,(H,27,28)