sodium 4-(2-methylprop-2-enoxy)-2-propyl-benzenesulfonate

Systemtic Name: sodium 4-(2-methylprop-2-enoxy)-2-propyl-benzenesulfonate Openeye Name: sodium 4-(2-methylallyloxy)-2-propyl-benzenesulfonate CAS Name: sodium 4-(2-methylprop-2-enoxy)-2-propylbenzenesulfonate IUPAC Name: sodium 4-(2-methylprop-2-enoxy)-2-propylbenzenesulfonate Traditional Name: sodium 4-(2-methylallyloxy)-2-propyl-besylate Formula: C13H17NaO4S MolecularWeight: 292.32645

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)OCC(=C)C)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCC1=C(C=CC(=C1)OCC(=C)C)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C13H18O4S.Na/c1-4-5-11-8-12(17-9-10(2)3)6-7-13(11)18(14,15)16;/h6-8H,2,4-5,9H2,1,3H3,(H,14,15,16);/q;+1/p-1