methyl 3-[2-[methylsulfonyl-(2,4,6-trimethylphenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[methylsulfonyl-(2,4,6-trimethylphenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(2,4,6-trimethyl-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-(2,4,6-trimethyl-N-methylsulfonylanilino)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(N-mesyl-2,4,6-trimethyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C)C

InChI

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