2-methyl-2-[3-[3-(7-methylsulfonyloxy-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[3-[3-(7-methylsulfonyloxy-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]phenoxy]propanoic acid Openeye Name: 2-methyl-2-[3-[3-(7-methylsulfonyloxy-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]phenoxy]propanoic acid CAS Name: 2-methyl-2-[3-[3-(7-methylsulfonyloxy-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]phenoxy]propanoic acid IUPAC Name: 2-methyl-2-[3-[3-(7-methylsulfonyloxy-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]phenoxy]propanoic acid Traditional Name: 2-methyl-2-[3-[3-(7-methylsulfonyloxy-2,3-dihydro-1,4-benzoxazin-4-yl)propyl]phenoxy]propionic acid Formula: C22H27NO7S MolecularWeight: 449.51728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=CC(=C1)CCCN2CCOC3=C2C=CC(=C3)OS(=O)(=O)C

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=CC(=C1)CCCN2CCOC3=C2C=CC(=C3)OS(=O)(=O)C

InChI

InChI=1S/C22H27NO7S/c1-22(2,21(24)25)29-17-8-4-6-16(14-17)7-5-11-23-12-13-28-20-15-18(9-10-19(20)23)30-31(3,26)27/h4,6,8-10,14-15H,5,7,11-13H2,1-3H3,(H,24,25)