ethyl 3-(4-methylsulfonyloxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: ethyl 3-(4-methylsulfonyloxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: ethyl 2-(benzyloxycarbonylamino)-3-(4-methylsulfonyloxyphenyl)propanoate CAS Name: 3-(4-methylsulfonyloxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-methylsulfonyloxyphenyl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(4-methylsulfonyloxyphenyl)propionic acid ethyl ester Formula: C20H23NO7S MolecularWeight: 421.46412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)OS(=O)(=O)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H23NO7S/c1-3-26-19(22)18(21-20(23)27-14-16-7-5-4-6-8-16)13-15-9-11-17(12-10-15)28-29(2,24)25/h4-12,18H,3,13-14H2,1-2H3,(H,21,23)