sodium 4-(3-methylbut-2-en-2-yl)benzoate

Systemtic Name: sodium 4-(3-methylbut-2-en-2-yl)benzoate Openeye Name: sodium 4-(1,2-dimethylprop-1-enyl)benzoate CAS Name: sodium 4-(3-methylbut-2-en-2-yl)benzoate IUPAC Name: sodium 4-(3-methylbut-2-en-2-yl)benzoate Traditional Name: sodium 4-(1,2-dimethylprop-1-enyl)benzoate Formula: C12H13NaO2 MolecularWeight: 212.22019

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O2.Na/c1-8(2)9(3)10-4-6-11(7-5-10)12(13)14;/h4-7H,1-3H3,(H,13,14);/q;+1/p-1