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

Systemtic Name: ethyl 2-acetamido-3-[4-(phenylsulfonyloxy)phenyl]propanoate Openeye Name: ethyl 2-acetamido-3-[4-(benzenesulfonyloxy)phenyl]propanoate CAS Name: 2-acetamido-3-[4-(benzenesulfonyloxy)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-3-[4-(benzenesulfonyloxy)phenyl]propanoate Traditional Name: 2-acetamido-3-(4-besyloxyphenyl)propionic acid ethyl ester Formula: C19H21NO6S MolecularWeight: 391.43814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO6S/c1-3-25-19(22)18(20-14(2)21)13-15-9-11-16(12-10-15)26-27(23,24)17-7-5-4-6-8-17/h4-12,18H,3,13H2,1-2H3,(H,20,21)