2-ethoxy-3-[3-methoxy-4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]propanoate

Systemtic Name: 2-ethoxy-3-[3-methoxy-4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]propanoate Openeye Name: 2-ethoxy-3-[3-methoxy-4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]propanoate CAS Name: 2-ethoxy-3-[3-methoxy-4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]propanoate IUPAC Name: 2-ethoxy-3-[3-methoxy-4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]propanoate Traditional Name: 2-ethoxy-3-[3-methoxy-4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]propionate Formula: C21H25O8S- MolecularWeight: 437.4834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC(=C(C=C1)OCCC2=CC=C(C=C2)OS(=O)(=O)C)OC)C(=O)[O-]

Isomeric SMILES

CCOC(CC1=CC(=C(C=C1)OCCC2=CC=C(C=C2)OS(=O)(=O)C)OC)C(=O)[O-]

InChI

InChI=1S/C21H26O8S/c1-4-27-20(21(22)23)14-16-7-10-18(19(13-16)26-2)28-12-11-15-5-8-17(9-6-15)29-30(3,24)25/h5-10,13,20H,4,11-12,14H2,1-3H3,(H,22,23)/p-1