methyl 2-[2-[(2-ethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(2-ethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[2-ethoxy-N-(p-tolylsulfonyl)anilino]acetyl]amino]benzoate CAS Name: 2-[[2-(2-ethoxy-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(2-ethoxy-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]benzoate Traditional Name: 2-[[2-(2-ethoxy-N-tosyl-anilino)acetyl]amino]benzoic acid methyl ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N(CC(=O)NC2=CC=CC=C2C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1N(CC(=O)NC2=CC=CC=C2C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H26N2O6S/c1-4-33-23-12-8-7-11-22(23)27(34(30,31)19-15-13-18(2)14-16-19)17-24(28)26-21-10-6-5-9-20(21)25(29)32-3/h5-16H,4,17H2,1-3H3,(H,26,28)