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

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

Systemtic Name:methyl 4-methyl-3-[2-[3-(methylsulfonylmethyl)phenyl]carbonyloxyethanoylamino]benzoate
Openeye Name:methyl 4-methyl-3-[[2-[3-(methylsulfonylmethyl)benzoyl]oxyacetyl]amino]benzoate
CAS Name:4-methyl-3-[[2-[[3-(methylsulfonylmethyl)phenyl]-oxomethoxy]-1-oxoethyl]amino]benzoic acid methyl ester
IUPAC Name:methyl 4-methyl-3-[[2-[3-(methylsulfonylmethyl)benzoyl]oxyacetyl]amino]benzoate
Traditional Name:3-[[2-[3-(mesylmethyl)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)C(=O)OC)NC(=O)COC(=O)C2=CC(=CC=C2)CS(=O)(=O)C


Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)C2=CC(=CC=C2)CS(=O)(=O)C


InChI

InChI=1S/C20H21NO7S/c1-13-7-8-16(19(23)27-2)10-17(13)21-18(22)11-28-20(24)15-6-4-5-14(9-15)12-29(3,25)26/h4-10H,11-12H2,1-3H3,(H,21,22)


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