methyl 3-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]propanoylamino]benzoate

Systemtic Name: methyl 3-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]propanoylamino]benzoate Openeye Name: methyl 3-[2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)propanoylamino]benzoate CAS Name: 3-[[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)propanoylamino]benzoate Traditional Name: 3-[2-(3-chloro-N-mesyl-4-methoxy-anilino)propanoylamino]benzoic acid methyl ester Formula: C19H21ClN2O6S MolecularWeight: 440.89784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)OC)N(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)OC)N(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

InChI

InChI=1S/C19H21ClN2O6S/c1-12(18(23)21-14-7-5-6-13(10-14)19(24)28-3)22(29(4,25)26)15-8-9-17(27-2)16(20)11-15/h5-12H,1-4H3,(H,21,23)