3-(4-tert-butylphenyl)-2-oxidanylidene-propanoate

Systemtic Name: 3-(4-tert-butylphenyl)-2-oxidanylidene-propanoate Openeye Name: 3-(4-tert-butylphenyl)-2-oxo-propanoate CAS Name: 3-(4-tert-butylphenyl)-2-oxopropanoate IUPAC Name: 3-(4-tert-butylphenyl)-2-oxopropanoate Traditional Name: 3-(4-tert-butylphenyl)-2-keto-propionate Formula: C13H15O3- MolecularWeight: 219.2564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O3/c1-13(2,3)10-6-4-9(5-7-10)8-11(14)12(15)16/h4-7H,8H2,1-3H3,(H,15,16)/p-1