[4-(1H-imidazol-2-yl)phenyl] 2-(2-hydroxyethyl)-3-methylsulfonyl-benzenecarboperoxoate

Systemtic Name: [4-(1H-imidazol-2-yl)phenyl] 2-(2-hydroxyethyl)-3-methylsulfonyl-benzenecarboperoxoate Openeye Name: [4-(1H-imidazol-2-yl)phenyl] 2-(2-hydroxyethyl)-3-methylsulfonyl-benzenecarboperoxoate CAS Name: 2-(2-hydroxyethyl)-3-methylsulfonylbenzenecarboperoxoic acid [4-(1H-imidazol-2-yl)phenyl] ester IUPAC Name: [4-(1H-imidazol-2-yl)phenyl] 2-(2-hydroxyethyl)-3-methylsulfonylbenzenecarboperoxoate Traditional Name: 2-(2-hydroxyethyl)-3-mesyl-benzenecarboperoxoic acid [4-(1H-imidazol-2-yl)phenyl] ester Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1CCO)C(=O)OOC2=CC=C(C=C2)C3=NC=CN3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1CCO)C(=O)OOC2=CC=C(C=C2)C3=NC=CN3

InChI

InChI=1S/C19H18N2O6S/c1-28(24,25)17-4-2-3-16(15(17)9-12-22)19(23)27-26-14-7-5-13(6-8-14)18-20-10-11-21-18/h2-8,10-11,22H,9,12H2,1H3,(H,20,21)