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

Systemtic Name: methyl 4-[2-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[2-[methyl(p-tolylsulfonyl)amino]acetyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[2-[methyl-(4-methylphenyl)sulfonylamino]-1-oxoethoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[2-[methyl(tosyl)amino]acetyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C20H22N2O7S MolecularWeight: 434.46288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H22N2O7S/c1-14-4-10-17(11-5-14)30(26,27)22(2)12-19(24)29-13-18(23)21-16-8-6-15(7-9-16)20(25)28-3/h4-11H,12-13H2,1-3H3,(H,21,23)