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

Systemtic Name: methyl 4-[2-[(4-fluorophenyl)-(4-methoxyphenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(4-fluoro-N-(4-methoxyphenyl)sulfonyl-anilino)acetyl]amino]benzoate CAS Name: 4-[[2-(4-fluoro-N-(4-methoxyphenyl)sulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-fluoro-N-(4-methoxyphenyl)sulfonylanilino)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-fluoro-N-(4-methoxyphenyl)sulfonyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C23H21FN2O6S MolecularWeight: 472.486043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)C(=O)OC)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)C(=O)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H21FN2O6S/c1-31-20-11-13-21(14-12-20)33(29,30)26(19-9-5-17(24)6-10-19)15-22(27)25-18-7-3-16(4-8-18)23(28)32-2/h3-14H,15H2,1-2H3,(H,25,27)