ethyl 4-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 4-[[2-(5-chloro-2-methyl-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-chloro-2-methyl-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 4-[[2-(5-chloro-N-mesyl-2-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=C(C=C1)NC(=O)CN(C2=C(C=CC(=C2)Cl)C)S(=O)(=O)C

Isomeric SMILES

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

InChI

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