phenethyl 2-oxidanylidene-4-phenyl-butanoate

Systemtic Name: phenethyl 2-oxidanylidene-4-phenyl-butanoate Openeye Name: phenethyl 2-oxo-4-phenyl-butanoate CAS Name: 2-oxo-4-phenylbutanoic acid phenethyl ester IUPAC Name: phenethyl 2-oxo-4-phenylbutanoate Traditional Name: 2-keto-4-phenyl-butyric acid phenethyl ester Formula: C18H18O3 MolecularWeight: 282.33372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)C(=O)OCCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)C(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C18H18O3/c19-17(12-11-15-7-3-1-4-8-15)18(20)21-14-13-16-9-5-2-6-10-16/h1-10H,11-14H2