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

Systemtic Name: methyl 2-chloranyl-5-[2-[(4-methoxyphenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-chloro-5-[[2-(4-methoxy-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 2-chloro-5-[[2-(4-methoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[[2-(4-methoxy-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 2-chloro-5-[[2-(N-mesyl-4-methoxy-anilino)acetyl]amino]benzoic acid methyl ester Formula: C18H19ClN2O6S MolecularWeight: 426.87126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)NC2=CC(=C(C=C2)Cl)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)NC2=CC(=C(C=C2)Cl)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C18H19ClN2O6S/c1-26-14-7-5-13(6-8-14)21(28(3,24)25)11-17(22)20-12-4-9-16(19)15(10-12)18(23)27-2/h4-10H,11H2,1-3H3,(H,20,22)