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

Systemtic Name: methyl 2-chloranyl-5-[2-[(2-fluorophenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-chloro-5-[[2-(2-fluoro-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 2-chloro-5-[[2-(2-fluoro-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[[2-(2-fluoro-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 2-chloro-5-[[2-(2-fluoro-N-mesyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C17H16ClFN2O5S MolecularWeight: 414.835743

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC(=O)CN(C2=CC=CC=C2F)S(=O)(=O)C)Cl

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC(=O)CN(C2=CC=CC=C2F)S(=O)(=O)C)Cl

InChI

InChI=1S/C17H16ClFN2O5S/c1-26-17(23)12-9-11(7-8-13(12)18)20-16(22)10-21(27(2,24)25)15-6-4-3-5-14(15)19/h3-9H,10H2,1-2H3,(H,20,22)