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

Systemtic Name: tert-butyl 2-acetamido-3-[4-(phenylsulfonyloxy)phenyl]propanoate Openeye Name: tert-butyl 2-acetamido-3-[4-(benzenesulfonyloxy)phenyl]propanoate CAS Name: 2-acetamido-3-[4-(benzenesulfonyloxy)phenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-acetamido-3-[4-(benzenesulfonyloxy)phenyl]propanoate Traditional Name: 2-acetamido-3-(4-besyloxyphenyl)propionic acid tert-butyl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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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(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO6S/c1-15(23)22-19(20(24)27-21(2,3)4)14-16-10-12-17(13-11-16)28-29(25,26)18-8-6-5-7-9-18/h5-13,19H,14H2,1-4H3,(H,22,23)