3-(4-methylphenyl)sulfonyl-2-[(E)-prop-1-enyl]peroxy-benzoic acid

Systemtic Name: 3-(4-methylphenyl)sulfonyl-2-[(E)-prop-1-enyl]peroxy-benzoic acid Openeye Name: 2-[(E)-prop-1-enyl]peroxy-3-(p-tolylsulfonyl)benzoic acid CAS Name: 3-(4-methylphenyl)sulfonyl-2-[(E)-prop-1-enyl]dioxybenzoic acid IUPAC Name: 3-(4-methylphenyl)sulfonyl-2-[(E)-prop-1-enyl]peroxybenzoic acid Traditional Name: 2-[(E)-prop-1-enyl]peroxy-3-tosyl-benzoic acid Formula: C17H16O6S MolecularWeight: 348.37034

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Descriptors Computed from Structure

Canonical SMILES:

CC=COOC1=C(C=CC=C1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)O

Isomeric SMILES

C/C=C/OOC1=C(C=CC=C1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)O

InChI

InChI=1S/C17H16O6S/c1-3-11-22-23-16-14(17(18)19)5-4-6-15(16)24(20,21)13-9-7-12(2)8-10-13/h3-11H,1-2H3,(H,18,19)/b11-3+