ethyl 3-[2-[(3-chloranyl-4-methyl-phenyl)-methylsulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[(3-chloranyl-4-methyl-phenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(3-chloro-4-methyl-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 3-[[2-(3-chloro-4-methyl-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3-chloro-4-methyl-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(3-chloro-N-mesyl-4-methyl-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C19H21ClN2O5S MolecularWeight: 424.89844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN(C2=CC(=C(C=C2)C)Cl)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN(C2=CC(=C(C=C2)C)Cl)S(=O)(=O)C

InChI

InChI=1S/C19H21ClN2O5S/c1-4-27-19(24)14-6-5-7-15(10-14)21-18(23)12-22(28(3,25)26)16-9-8-13(2)17(20)11-16/h5-11H,4,12H2,1-3H3,(H,21,23)