methyl 4-[2-[(5-fluoranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(5-fluoranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(5-fluoro-2-methoxy-phenyl)sulfonyl-methyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-fluoro-2-methoxy-phenyl)sulfonyl-methyl-amino]acetyl]amino]benzoic acid methyl ester Formula: C18H19FN2O6S MolecularWeight: 410.416663

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=C(C=CC(=C2)F)OC

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C18H19FN2O6S/c1-21(28(24,25)16-10-13(19)6-9-15(16)26-2)11-17(22)20-14-7-4-12(5-8-14)18(23)27-3/h4-10H,11H2,1-3H3,(H,20,22)