sodium 2-[4-(2-methylpropyl)phenyl]ethanoate

Systemtic Name: sodium 2-[4-(2-methylpropyl)phenyl]ethanoate Openeye Name: sodium 2-(4-isobutylphenyl)acetate CAS Name: sodium 2-[4-(2-methylpropyl)phenyl]acetate IUPAC Name: sodium 2-[4-(2-methylpropyl)phenyl]acetate Traditional Name: sodium 2-(4-isobutylphenyl)acetate Formula: C12H15NaO2 MolecularWeight: 214.23607

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O2.Na/c1-9(2)7-10-3-5-11(6-4-10)8-12(13)14;/h3-6,9H,7-8H2,1-2H3,(H,13,14);/q;+1/p-1