[5-methyl-2-(1,3-oxazol-2-yl)phenyl] 2-[4-(hydroxymethyl)-2-methoxy-phenoxy]ethanesulfonate

Systemtic Name: [5-methyl-2-(1,3-oxazol-2-yl)phenyl] 2-[4-(hydroxymethyl)-2-methoxy-phenoxy]ethanesulfonate Openeye Name: (5-methyl-2-oxazol-2-yl-phenyl) 2-[4-(hydroxymethyl)-2-methoxy-phenoxy]ethanesulfonate CAS Name: 2-[4-(hydroxymethyl)-2-methoxyphenoxy]ethanesulfonic acid [5-methyl-2-(2-oxazolyl)phenyl] ester IUPAC Name: [5-methyl-2-(1,3-oxazol-2-yl)phenyl] 2-[4-(hydroxymethyl)-2-methoxyphenoxy]ethanesulfonate Traditional Name: 2-(2-methoxy-4-methylol-phenoxy)ethanesulfonic acid (5-methyl-2-oxazol-2-yl-phenyl) ester Formula: C20H21NO7S MolecularWeight: 419.44824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC=CO2)OS(=O)(=O)CCOC3=C(C=C(C=C3)CO)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC=CO2)OS(=O)(=O)CCOC3=C(C=C(C=C3)CO)OC

InChI

InChI=1S/C20H21NO7S/c1-14-3-5-16(20-21-7-8-27-20)18(11-14)28-29(23,24)10-9-26-17-6-4-15(13-22)12-19(17)25-2/h3-8,11-12,22H,9-10,13H2,1-2H3