(2,3-diethylphenyl) 2-chloranyl-2-oxidanylidene-ethanoate

Systemtic Name: (2,3-diethylphenyl) 2-chloranyl-2-oxidanylidene-ethanoate Openeye Name: (2,3-diethylphenyl) 2-chloro-2-oxo-acetate CAS Name: 2-chloro-2-oxoacetic acid (2,3-diethylphenyl) ester IUPAC Name: (2,3-diethylphenyl) 2-chloro-2-oxoacetate Traditional Name: 2-chloro-2-keto-acetic acid (2,3-diethylphenyl) ester Formula: C12H13ClO3 MolecularWeight: 240.68282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)OC(=O)C(=O)Cl)CC

Isomeric SMILES

CCC1=C(C(=CC=C1)OC(=O)C(=O)Cl)CC

InChI

InChI=1S/C12H13ClO3/c1-3-8-6-5-7-10(9(8)4-2)16-12(15)11(13)14/h5-7H,3-4H2,1-2H3