[4-(2-acetamidopropyl)phenyl]carbonyloxymethanesulfonate

Systemtic Name: [4-(2-acetamidopropyl)phenyl]carbonyloxymethanesulfonate Openeye Name: [4-(2-acetamidopropyl)benzoyl]oxymethanesulfonate CAS Name: [[4-(2-acetamidopropyl)phenyl]-oxomethoxy]methanesulfonate IUPAC Name: [4-(2-acetamidopropyl)benzoyl]oxymethanesulfonate Traditional Name: [4-(2-acetamidopropyl)benzoyl]oxymethanesulfonate Formula: C13H16NO6S- MolecularWeight: 314.33424

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C(=O)OCS(=O)(=O)[O-])NC(=O)C

Isomeric SMILES

CC(CC1=CC=C(C=C1)C(=O)OCS(=O)(=O)[O-])NC(=O)C

InChI

InChI=1S/C13H17NO6S/c1-9(14-10(2)15)7-11-3-5-12(6-4-11)13(16)20-8-21(17,18)19/h3-6,9H,7-8H2,1-2H3,(H,14,15)(H,17,18,19)/p-1