methyl 4-methyl-3-[2-(2-methyl-5-methylsulfonyl-phenyl)carbonyloxyethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-(2-methyl-5-methylsulfonyl-phenyl)carbonyloxyethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-(2-methyl-5-methylsulfonyl-benzoyl)oxyacetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-[(2-methyl-5-methylsulfonylphenyl)-oxomethoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(2-methyl-5-methylsulfonylbenzoyl)oxyacetyl]amino]benzoate Traditional Name: 3-[[2-(5-mesyl-2-methyl-benzoyl)oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C20H21NO7S MolecularWeight: 419.44824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO7S/c1-12-6-8-15(29(4,25)26)10-16(12)20(24)28-11-18(22)21-17-9-14(19(23)27-3)7-5-13(17)2/h5-10H,11H2,1-4H3,(H,21,22)