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

Systemtic Name: ethyl 2-ethoxy-3-[4-[2-(4-methylsulfonyloxyphenyl)ethanoylamino]phenyl]propanoate Openeye Name: ethyl 2-ethoxy-3-[4-[[2-(4-methylsulfonyloxyphenyl)acetyl]amino]phenyl]propanoate CAS Name: 2-ethoxy-3-[4-[[2-(4-methylsulfonyloxyphenyl)-1-oxoethyl]amino]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-ethoxy-3-[4-[[2-(4-methylsulfonyloxyphenyl)acetyl]amino]phenyl]propanoate Traditional Name: 2-ethoxy-3-[4-[[2-(4-methylsulfonyloxyphenyl)acetyl]amino]phenyl]propionic acid ethyl ester Formula: C22H27NO7S MolecularWeight: 449.51728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)NC(=O)CC2=CC=C(C=C2)OS(=O)(=O)C)C(=O)OCC

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)NC(=O)CC2=CC=C(C=C2)OS(=O)(=O)C)C(=O)OCC

InChI

InChI=1S/C22H27NO7S/c1-4-28-20(22(25)29-5-2)14-16-6-10-18(11-7-16)23-21(24)15-17-8-12-19(13-9-17)30-31(3,26)27/h6-13,20H,4-5,14-15H2,1-3H3,(H,23,24)