ethyl 3-[2-[(4-ethoxyphenyl)sulfonyl-(4-methylphenyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[(4-ethoxyphenyl)sulfonyl-(4-methylphenyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(N-(4-ethoxyphenyl)sulfonyl-4-methyl-anilino)acetyl]amino]benzoate CAS Name: 3-[[2-(N-(4-ethoxyphenyl)sulfonyl-4-methylanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(N-(4-ethoxyphenyl)sulfonyl-4-methylanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-methyl-N-p-phenetylsulfonyl-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C26H28N2O6S MolecularWeight: 496.57532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC(=C2)C(=O)OCC)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC(=C2)C(=O)OCC)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H28N2O6S/c1-4-33-23-13-15-24(16-14-23)35(31,32)28(22-11-9-19(3)10-12-22)18-25(29)27-21-8-6-7-20(17-21)26(30)34-5-2/h6-17H,4-5,18H2,1-3H3,(H,27,29)