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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(CC(=O)NC2=CC=CC(=C2C)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N(CC(=O)NC2=CC=CC(=C2C)C(=O)OC)S(=O)(=O)C

InChI

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