[1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 3-(phenylsulfonyl)propanoate

Systemtic Name: [1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 3-(phenylsulfonyl)propanoate Openeye Name: [2-(4-benzyloxyanilino)-1-methyl-2-oxo-ethyl] 3-(benzenesulfonyl)propanoate CAS Name: 3-(benzenesulfonyl)propanoic acid [1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] 3-(benzenesulfonyl)propanoate Traditional Name: 3-besylpropionic acid [2-(4-benzoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C25H25NO6S MolecularWeight: 467.5341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H25NO6S/c1-19(32-24(27)16-17-33(29,30)23-10-6-3-7-11-23)25(28)26-21-12-14-22(15-13-21)31-18-20-8-4-2-5-9-20/h2-15,19H,16-18H2,1H3,(H,26,28)