methyl 2-ethyl-4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: methyl 2-ethyl-4-oxidanylidene-4-phenyl-butanoate Openeye Name: methyl 2-ethyl-4-oxo-4-phenyl-butanoate CAS Name: 2-ethyl-4-oxo-4-phenylbutanoic acid methyl ester IUPAC Name: methyl 2-ethyl-4-oxo-4-phenylbutanoate Traditional Name: 2-ethyl-4-keto-4-phenyl-butyric acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCC(CC(=O)C1=CC=CC=C1)C(=O)OC

InChI

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