methyl 2-acetamido-3-[4-(phenylsulfonyloxy)phenyl]propanoate

Systemtic Name: methyl 2-acetamido-3-[4-(phenylsulfonyloxy)phenyl]propanoate Openeye Name: methyl 2-acetamido-3-[4-(benzenesulfonyloxy)phenyl]propanoate CAS Name: 2-acetamido-3-[4-(benzenesulfonyloxy)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-acetamido-3-[4-(benzenesulfonyloxy)phenyl]propanoate Traditional Name: 2-acetamido-3-(4-besyloxyphenyl)propionic acid methyl ester Formula: C18H19NO6S MolecularWeight: 377.41156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(=O)NC(CC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H19NO6S/c1-13(20)19-17(18(21)24-2)12-14-8-10-15(11-9-14)25-26(22,23)16-6-4-3-5-7-16/h3-11,17H,12H2,1-2H3,(H,19,20)