ethyl 4-[2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(4-methylphenyl)sulfonyl-phenyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[N-(p-tolylsulfonyl)anilino]acetyl]amino]benzoate CAS Name: 4-[[2-(N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzoate Traditional Name: 4-[[2-(N-tosylanilino)acetyl]amino]benzoic acid ethyl ester Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N2O5S/c1-3-31-24(28)19-11-13-20(14-12-19)25-23(27)17-26(21-7-5-4-6-8-21)32(29,30)22-15-9-18(2)10-16-22/h4-16H,3,17H2,1-2H3,(H,25,27)