methyl 3-[2-[(2-fluorophenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 3-[2-[(2-fluorophenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-[N-(benzenesulfonyl)-2-fluoro-anilino]acetyl]amino]benzoate CAS Name: 3-[[2-[N-(benzenesulfonyl)-2-fluoroanilino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-[N-(benzenesulfonyl)-2-fluoroanilino]acetyl]amino]benzoate Traditional Name: 3-[[2-(N-besyl-2-fluoro-anilino)acetyl]amino]benzoic acid methyl ester Formula: C22H19FN2O5S MolecularWeight: 442.460063

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)CN(C2=CC=CC=C2F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)CN(C2=CC=CC=C2F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H19FN2O5S/c1-30-22(27)16-8-7-9-17(14-16)24-21(26)15-25(20-13-6-5-12-19(20)23)31(28,29)18-10-3-2-4-11-18/h2-14H,15H2,1H3,(H,24,26)