tert-butyl 2-acetamido-3-[3-(4-methylphenyl)sulfonyloxyphenyl]propanoate

Systemtic Name: tert-butyl 2-acetamido-3-[3-(4-methylphenyl)sulfonyloxyphenyl]propanoate Openeye Name: tert-butyl 2-acetamido-3-[3-(p-tolylsulfonyloxy)phenyl]propanoate CAS Name: 2-acetamido-3-[3-(4-methylphenyl)sulfonyloxyphenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-acetamido-3-[3-(4-methylphenyl)sulfonyloxyphenyl]propanoate Traditional Name: 2-acetamido-3-(3-tosyloxyphenyl)propionic acid tert-butyl ester Formula: C22H27NO6S MolecularWeight: 433.51788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)CC(C(=O)OC(C)(C)C)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)CC(C(=O)OC(C)(C)C)NC(=O)C

InChI

InChI=1S/C22H27NO6S/c1-15-9-11-19(12-10-15)30(26,27)29-18-8-6-7-17(13-18)14-20(23-16(2)24)21(25)28-22(3,4)5/h6-13,20H,14H2,1-5H3,(H,23,24)