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

Systemtic Name: methyl 3-[2-[(2-ethylphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(2-ethyl-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 3-[[2-(2-ethyl-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-ethyl-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(2-ethyl-N-mesyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C19H22N2O5S/c1-4-14-8-5-6-11-17(14)21(27(3,24)25)13-18(22)20-16-10-7-9-15(12-16)19(23)26-2/h5-12H,4,13H2,1-3H3,(H,20,22)