2-[3-[3-(5-methylsulfonyloxyindol-1-yl)propyl]phenoxy]propanoic acid

Systemtic Name: 2-[3-[3-(5-methylsulfonyloxyindol-1-yl)propyl]phenoxy]propanoic acid Openeye Name: 2-[3-[3-(5-methylsulfonyloxyindol-1-yl)propyl]phenoxy]propanoic acid CAS Name: 2-[3-[3-(5-methylsulfonyloxy-1-indolyl)propyl]phenoxy]propanoic acid IUPAC Name: 2-[3-[3-(5-methylsulfonyloxyindol-1-yl)propyl]phenoxy]propanoic acid Traditional Name: 2-[3-[3-(5-methylsulfonyloxyindol-1-yl)propyl]phenoxy]propionic acid Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=CC(=C1)CCCN2C=CC3=C2C=CC(=C3)OS(=O)(=O)C

Isomeric SMILES

CC(C(=O)O)OC1=CC=CC(=C1)CCCN2C=CC3=C2C=CC(=C3)OS(=O)(=O)C

InChI

InChI=1S/C21H23NO6S/c1-15(21(23)24)27-18-7-3-5-16(13-18)6-4-11-22-12-10-17-14-19(8-9-20(17)22)28-29(2,25)26/h3,5,7-10,12-15H,4,6,11H2,1-2H3,(H,23,24)