ethyl 3-[2-[(4-ethylphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[(4-ethylphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(4-ethyl-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 3-[[2-(4-ethyl-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-ethyl-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-ethyl-N-mesyl-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O5S/c1-4-15-9-11-18(12-10-15)22(28(3,25)26)14-19(23)21-17-8-6-7-16(13-17)20(24)27-5-2/h6-13H,4-5,14H2,1-3H3,(H,21,23)