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

Systemtic Name: methyl 2-[2-[(4-ethoxyphenyl)sulfonyl-ethyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[(4-ethoxyphenyl)sulfonyl-ethyl-amino]acetyl]amino]benzoate CAS Name: 2-[[2-[(4-ethoxyphenyl)sulfonyl-ethylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-ethoxyphenyl)sulfonyl-ethylamino]acetyl]amino]benzoate Traditional Name: 2-[[2-[ethyl(p-phenetylsulfonyl)amino]acetyl]amino]benzoic acid methyl ester Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC=CC=C1C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCN(CC(=O)NC1=CC=CC=C1C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C20H24N2O6S/c1-4-22(29(25,26)16-12-10-15(11-13-16)28-5-2)14-19(23)21-18-9-7-6-8-17(18)20(24)27-3/h6-13H,4-5,14H2,1-3H3,(H,21,23)