2-methylpropanoate benzoate

Systemtic Name: 2-methylpropanoate benzoate Openeye Name: 2-methylpropanoate benzoate CAS Name: 2-methylpropanoate benzoate IUPAC Name: 2-methylpropanoate benzoate Traditional Name: benzoate isobutyrate Formula: C11H12O4-2 MolecularWeight: 208.21058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H6O2.C4H8O2/c8-7(9)6-4-2-1-3-5-6;1-3(2)4(5)6/h1-5H,(H,8,9);3H,1-2H3,(H,5,6)/p-2