(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-(methylsulfonylmethyl)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-(methylsulfonylmethyl)benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 3-(methylsulfonylmethyl)benzoate CAS Name: 3-(methylsulfonylmethyl)benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 3-(methylsulfonylmethyl)benzoate Traditional Name: 3-(mesylmethyl)benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N

Isomeric SMILES

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C17H17NO5S/c1-24(21,22)11-12-6-5-9-14(10-12)17(20)23-15(16(18)19)13-7-3-2-4-8-13/h2-10,15H,11H2,1H3,(H2,18,19)