4-chloranyl-3-oxidanylidene-2-(1-phenylethyl)butanoate

Systemtic Name: 4-chloranyl-3-oxidanylidene-2-(1-phenylethyl)butanoate Openeye Name: 4-chloro-3-oxo-2-(1-phenylethyl)butanoate CAS Name: 4-chloro-3-oxo-2-(1-phenylethyl)butanoate IUPAC Name: 4-chloro-3-oxo-2-(1-phenylethyl)butanoate Traditional Name: 4-chloro-3-keto-2-(1-phenylethyl)butyrate Formula: C12H12ClO3- MolecularWeight: 239.67488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClO3/c1-8(9-5-3-2-4-6-9)11(12(15)16)10(14)7-13/h2-6,8,11H,7H2,1H3,(H,15,16)/p-1