3-[6-(2-hydroxyethyloxy)pyridin-2-yl]-2-methyl-3-(3-methylphenyl)-2-piperidin-1-ylsulfonyl-propanoic acid

Systemtic Name: 3-[6-(2-hydroxyethyloxy)pyridin-2-yl]-2-methyl-3-(3-methylphenyl)-2-piperidin-1-ylsulfonyl-propanoic acid Openeye Name: 3-[6-(2-hydroxyethoxy)-2-pyridyl]-2-methyl-3-(m-tolyl)-2-(1-piperidylsulfonyl)propanoic acid CAS Name: 3-[6-(2-hydroxyethoxy)-2-pyridinyl]-2-methyl-3-(3-methylphenyl)-2-(1-piperidinylsulfonyl)propanoic acid IUPAC Name: 3-[6-(2-hydroxyethoxy)pyridin-2-yl]-2-methyl-3-(3-methylphenyl)-2-piperidin-1-ylsulfonylpropanoic acid Traditional Name: 3-[6-(2-hydroxyethoxy)-2-pyridyl]-2-methyl-3-(m-tolyl)-2-piperidinosulfonyl-propionic acid Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=NC(=CC=C2)OCCO)C(C)(C(=O)O)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=NC(=CC=C2)OCCO)C(C)(C(=O)O)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H30N2O6S/c1-17-8-6-9-18(16-17)21(19-10-7-11-20(24-19)31-15-14-26)23(2,22(27)28)32(29,30)25-12-4-3-5-13-25/h6-11,16,21,26H,3-5,12-15H2,1-2H3,(H,27,28)