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

Systemtic Name: methyl 4-[2-[(4-fluorophenyl)sulfonyl-phenyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(N-(4-fluorophenyl)sulfonylanilino)acetyl]amino]benzoate CAS Name: 4-[[2-(N-(4-fluorophenyl)sulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(N-(4-fluorophenyl)sulfonylanilino)acetyl]amino]benzoate Traditional Name: 4-[[2-(N-(4-fluorophenyl)sulfonylanilino)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=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

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

InChI

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