(phenylmethyl) 3-methylsulfonyloxy-2-(3-phenylpropanoylamino)propanoate

Systemtic Name: (phenylmethyl) 3-methylsulfonyloxy-2-(3-phenylpropanoylamino)propanoate Openeye Name: benzyl 3-methylsulfonyloxy-2-(3-phenylpropanoylamino)propanoate CAS Name: 3-methylsulfonyloxy-2-[(1-oxo-3-phenylpropyl)amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-methylsulfonyloxy-2-(3-phenylpropanoylamino)propanoate Traditional Name: 2-(hydrocinnamoylamino)-3-methylsulfonyloxy-propionic acid benzyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC(C(=O)OCC1=CC=CC=C1)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)OCC(C(=O)OCC1=CC=CC=C1)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C20H23NO6S/c1-28(24,25)27-15-18(20(23)26-14-17-10-6-3-7-11-17)21-19(22)13-12-16-8-4-2-5-9-16/h2-11,18H,12-15H2,1H3,(H,21,22)