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

Systemtic Name: 2-[2-[(2-ethylphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: 2-[[2-(2-ethyl-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 2-[[2-(2-ethyl-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoate IUPAC Name: 2-[[2-(2-ethyl-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 2-[[2-(2-ethyl-N-mesyl-anilino)acetyl]amino]benzoate Formula: C18H19N2O5S- MolecularWeight: 375.41886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(CC(=O)NC2=CC=CC=C2C(=O)[O-])S(=O)(=O)C

Isomeric SMILES

CCC1=CC=CC=C1N(CC(=O)NC2=CC=CC=C2C(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C18H20N2O5S/c1-3-13-8-4-7-11-16(13)20(26(2,24)25)12-17(21)19-15-10-6-5-9-14(15)18(22)23/h4-11H,3,12H2,1-2H3,(H,19,21)(H,22,23)/p-1