ethyl 4-chloranyl-4-oxidanylidene-2-(phenylmethyl)butanoate

Systemtic Name: ethyl 4-chloranyl-4-oxidanylidene-2-(phenylmethyl)butanoate Openeye Name: ethyl 2-benzyl-4-chloro-4-oxo-butanoate CAS Name: 4-chloro-4-oxo-2-(phenylmethyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-benzyl-4-chloro-4-oxobutanoate Traditional Name: 2-benzyl-4-chloro-4-keto-butyric acid ethyl ester Formula: C13H15ClO3 MolecularWeight: 254.7094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)CC(=O)Cl

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)CC(=O)Cl

InChI

InChI=1S/C13H15ClO3/c1-2-17-13(16)11(9-12(14)15)8-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3