2-[(E)-but-2-enyl]peroxy-3-(phenylsulfonyl)benzoic acid

Systemtic Name: 2-[(E)-but-2-enyl]peroxy-3-(phenylsulfonyl)benzoic acid Openeye Name: 3-(benzenesulfonyl)-2-[(E)-but-2-enyl]peroxy-benzoic acid CAS Name: 3-(benzenesulfonyl)-2-[(E)-but-2-enyl]dioxybenzoic acid IUPAC Name: 3-(benzenesulfonyl)-2-[(E)-but-2-enyl]peroxybenzoic acid Traditional Name: 3-besyl-2-[(E)-but-2-enyl]peroxy-benzoic acid Formula: C17H16O6S MolecularWeight: 348.37034

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCOOC1=C(C=CC=C1S(=O)(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C17H16O6S/c1-2-3-12-22-23-16-14(17(18)19)10-7-11-15(16)24(20,21)13-8-5-4-6-9-13/h2-11H,12H2,1H3,(H,18,19)/b3-2+