[(2S)-1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 3-(3-methylphenoxy)propanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 3-(3-methylphenoxy)propanoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] 3-(3-methylphenoxy)propanoate CAS Name: 3-(3-methylphenoxy)propanoic acid [(2S)-1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(3-sulfamoylanilino)propan-2-yl] 3-(3-methylphenoxy)propanoate Traditional Name: 3-(3-methylphenoxy)propionic acid [(1S)-2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCC(=O)OC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCC(=O)O[C@@H](C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C19H22N2O6S/c1-13-5-3-7-16(11-13)26-10-9-18(22)27-14(2)19(23)21-15-6-4-8-17(12-15)28(20,24)25/h3-8,11-12,14H,9-10H2,1-2H3,(H,21,23)(H2,20,24,25)/t14-/m0/s1