[(2S)-1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] (E)-3-(4-ethylphenyl)prop-2-enoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] (E)-3-(4-ethylphenyl)prop-2-enoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] (E)-3-(4-ethylphenyl)prop-2-enoate CAS Name: (E)-3-(4-ethylphenyl)-2-propenoic acid [(2S)-1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(3-sulfamoylanilino)propan-2-yl] (E)-3-(4-ethylphenyl)prop-2-enoate Traditional Name: (E)-3-(4-ethylphenyl)acrylic acid [(1S)-2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C20H22N2O5S MolecularWeight: 402.46408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=CC(=O)OC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C/C(=O)O[C@@H](C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C20H22N2O5S/c1-3-15-7-9-16(10-8-15)11-12-19(23)27-14(2)20(24)22-17-5-4-6-18(13-17)28(21,25)26/h4-14H,3H2,1-2H3,(H,22,24)(H2,21,25,26)/b12-11+/t14-/m0/s1