methyl 4-[[[3-(methylsulfonylmethyl)phenyl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[3-(methylsulfonylmethyl)phenyl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[3-(methylsulfonylmethyl)benzoyl]amino]methyl]benzoate CAS Name: 4-[[[[3-(methylsulfonylmethyl)phenyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[3-(methylsulfonylmethyl)benzoyl]amino]methyl]benzoate Traditional Name: 4-[[[3-(mesylmethyl)benzoyl]amino]methyl]benzoic acid methyl ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)CS(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)CS(=O)(=O)C

InChI

InChI=1S/C18H19NO5S/c1-24-18(21)15-8-6-13(7-9-15)11-19-17(20)16-5-3-4-14(10-16)12-25(2,22)23/h3-10H,11-12H2,1-2H3,(H,19,20)