2-methyl-2-(2-methylfuran-3-yl)sulfonyl-3-[4-(2-piperidin-2-ylethoxy)phenyl]propanoic acid

Systemtic Name: 2-methyl-2-(2-methylfuran-3-yl)sulfonyl-3-[4-(2-piperidin-2-ylethoxy)phenyl]propanoic acid Openeye Name: 2-methyl-2-[(2-methyl-3-furyl)sulfonyl]-3-[4-[2-(2-piperidyl)ethoxy]phenyl]propanoic acid CAS Name: 2-methyl-2-[(2-methyl-3-furanyl)sulfonyl]-3-[4-[2-(2-piperidinyl)ethoxy]phenyl]propanoic acid IUPAC Name: 2-methyl-2-(2-methylfuran-3-yl)sulfonyl-3-[4-(2-piperidin-2-ylethoxy)phenyl]propanoic acid Traditional Name: 2-methyl-2-[(2-methyl-3-furyl)sulfonyl]-3-[4-[2-(2-piperidyl)ethoxy]phenyl]propionic acid Formula: C22H29NO6S MolecularWeight: 435.53376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)S(=O)(=O)C(C)(CC2=CC=C(C=C2)OCCC3CCCCN3)C(=O)O

Isomeric SMILES

CC1=C(C=CO1)S(=O)(=O)C(C)(CC2=CC=C(C=C2)OCCC3CCCCN3)C(=O)O

InChI

InChI=1S/C22H29NO6S/c1-16-20(11-14-28-16)30(26,27)22(2,21(24)25)15-17-6-8-19(9-7-17)29-13-10-18-5-3-4-12-23-18/h6-9,11,14,18,23H,3-5,10,12-13,15H2,1-2H3,(H,24,25)