2-oxidanylidene-3-(2,4,6-trimethylphenyl)propanoate

Systemtic Name: 2-oxidanylidene-3-(2,4,6-trimethylphenyl)propanoate Openeye Name: 2-oxo-3-(2,4,6-trimethylphenyl)propanoate CAS Name: 2-oxo-3-(2,4,6-trimethylphenyl)propanoate IUPAC Name: 2-oxo-3-(2,4,6-trimethylphenyl)propanoate Traditional Name: 2-keto-3-mesityl-propionate Formula: C12H13O3- MolecularWeight: 205.22982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CC(=O)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CC(=O)C(=O)[O-])C

InChI

InChI=1S/C12H14O3/c1-7-4-8(2)10(9(3)5-7)6-11(13)12(14)15/h4-5H,6H2,1-3H3,(H,14,15)/p-1