2-[4-[4-[3-(2-methoxyethoxy)phenyl]-3-methyl-phenyl]piperidin-1-yl]sulfonyl-2-methyl-propanoic acid

Systemtic Name: 2-[4-[4-[3-(2-methoxyethoxy)phenyl]-3-methyl-phenyl]piperidin-1-yl]sulfonyl-2-methyl-propanoic acid Openeye Name: 2-[[4-[4-[3-(2-methoxyethoxy)phenyl]-3-methyl-phenyl]-1-piperidyl]sulfonyl]-2-methyl-propanoic acid CAS Name: 2-[[4-[4-[3-(2-methoxyethoxy)phenyl]-3-methylphenyl]-1-piperidinyl]sulfonyl]-2-methylpropanoic acid IUPAC Name: 2-[4-[4-[3-(2-methoxyethoxy)phenyl]-3-methylphenyl]piperidin-1-yl]sulfonyl-2-methylpropanoic acid Traditional Name: 2-[4-[4-[3-(2-methoxyethoxy)phenyl]-3-methyl-phenyl]piperidino]sulfonyl-2-methyl-propionic acid Formula: C25H33NO6S MolecularWeight: 475.59762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C(C)(C)C(=O)O)C3=CC(=CC=C3)OCCOC

Isomeric SMILES

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C(C)(C)C(=O)O)C3=CC(=CC=C3)OCCOC

InChI

InChI=1S/C25H33NO6S/c1-18-16-20(8-9-23(18)21-6-5-7-22(17-21)32-15-14-31-4)19-10-12-26(13-11-19)33(29,30)25(2,3)24(27)28/h5-9,16-17,19H,10-15H2,1-4H3,(H,27,28)