methyl 4-[2-[(4-fluorophenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(4-fluorophenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[N-(benzenesulfonyl)-4-fluoro-anilino]acetyl]amino]benzoate CAS Name: 4-[[2-[N-(benzenesulfonyl)-4-fluoroanilino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[N-(benzenesulfonyl)-4-fluoroanilino]acetyl]amino]benzoate Traditional Name: 4-[[2-(N-besyl-4-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=C(C=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

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