(2-azanyl-2-oxidanylidene-ethyl) 4-(methylsulfonylmethyl)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-(methylsulfonylmethyl)benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-(methylsulfonylmethyl)benzoate CAS Name: 4-(methylsulfonylmethyl)benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-(methylsulfonylmethyl)benzoate Traditional Name: 4-(mesylmethyl)benzoic acid (2-amino-2-keto-ethyl) ester Formula: C11H13NO5S MolecularWeight: 271.28962

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OCC(=O)N

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)OCC(=O)N

InChI

InChI=1S/C11H13NO5S/c1-18(15,16)7-8-2-4-9(5-3-8)11(14)17-6-10(12)13/h2-5H,6-7H2,1H3,(H2,12,13)