sodium 3-methyl-5-(2-methylprop-2-enoxy)benzenesulfonate

Systemtic Name: sodium 3-methyl-5-(2-methylprop-2-enoxy)benzenesulfonate Openeye Name: sodium 3-methyl-5-(2-methylallyloxy)benzenesulfonate CAS Name: sodium 3-methyl-5-(2-methylprop-2-enoxy)benzenesulfonate IUPAC Name: sodium 3-methyl-5-(2-methylprop-2-enoxy)benzenesulfonate Traditional Name: sodium 3-methyl-5-(2-methylallyloxy)besylate Formula: C11H13NaO4S MolecularWeight: 264.27329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)[O-])OCC(=C)C.[Na+]

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)[O-])OCC(=C)C.[Na+]

InChI

InChI=1S/C11H14O4S.Na/c1-8(2)7-15-10-4-9(3)5-11(6-10)16(12,13)14;/h4-6H,1,7H2,2-3H3,(H,12,13,14);/q;+1/p-1