[2-[2-[2-(4-methylsulfonylphenyl)carbonyloxyethanoylamino]ethylamino]-2-oxidanylidene-ethyl] 4-methylsulfonylbenzoate

Systemtic Name: [2-[2-[2-(4-methylsulfonylphenyl)carbonyloxyethanoylamino]ethylamino]-2-oxidanylidene-ethyl] 4-methylsulfonylbenzoate Openeye Name: [2-[2-[[2-(4-methylsulfonylbenzoyl)oxyacetyl]amino]ethylamino]-2-oxo-ethyl] 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid [2-[2-[[2-[(4-methylsulfonylphenyl)-oxomethoxy]-1-oxoethyl]amino]ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-[[2-(4-methylsulfonylbenzoyl)oxyacetyl]amino]ethylamino]-2-oxoethyl] 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid [2-keto-2-[2-[[2-(4-mesylbenzoyl)oxyacetyl]amino]ethylamino]ethyl] ester Formula: C22H24N2O10S2 MolecularWeight: 540.56336

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NCCNC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NCCNC(=O)COC(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C22H24N2O10S2/c1-35(29,30)17-7-3-15(4-8-17)21(27)33-13-19(25)23-11-12-24-20(26)14-34-22(28)16-5-9-18(10-6-16)36(2,31)32/h3-10H,11-14H2,1-2H3,(H,23,25)(H,24,26)