10,10-dimethylundecanoic acid benzoate

Systemtic Name: 10,10-dimethylundecanoic acid benzoate Openeye Name: 10,10-dimethylundecanoic acid benzoate CAS Name: 10,10-dimethylundecanoic acid benzoate IUPAC Name: 10,10-dimethylundecanoic acid benzoate Traditional Name: 10,10-dimethylundecanoic acid benzoate Formula: C20H31O4- MolecularWeight: 335.45774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCCCCC(=O)O.C1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

CC(C)(C)CCCCCCCCC(=O)O.C1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C13H26O2.C7H6O2/c1-13(2,3)11-9-7-5-4-6-8-10-12(14)15;8-7(9)6-4-2-1-3-5-6/h4-11H2,1-3H3,(H,14,15);1-5H,(H,8,9)/p-1