2-[[2-(phenylsulfonyl)propanoylamino]methylperoxy]benzoic acid

Systemtic Name: 2-[[2-(phenylsulfonyl)propanoylamino]methylperoxy]benzoic acid Openeye Name: 2-[[2-(benzenesulfonyl)propanoylamino]methylperoxy]benzoic acid CAS Name: 2-[[[2-(benzenesulfonyl)-1-oxopropyl]amino]methyldioxy]benzoic acid IUPAC Name: 2-[[2-(benzenesulfonyl)propanoylamino]methylperoxy]benzoic acid Traditional Name: 2-[(2-besylpropanoylamino)methylperoxy]benzoic acid Formula: C17H17NO7S MolecularWeight: 379.38438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCOOC1=CC=CC=C1C(=O)O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NCOOC1=CC=CC=C1C(=O)O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H17NO7S/c1-12(26(22,23)13-7-3-2-4-8-13)16(19)18-11-24-25-15-10-6-5-9-14(15)17(20)21/h2-10,12H,11H2,1H3,(H,18,19)(H,20,21)