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

Systemtic Name: (phenylmethyl) 4-oxidanylidene-2-(phenylmethyl)butanoate Openeye Name: benzyl 2-benzyl-4-oxo-butanoate CAS Name: 4-oxo-2-(phenylmethyl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-benzyl-4-oxobutanoate Traditional Name: 2-benzyl-4-keto-butyric acid benzyl ester Formula: C18H18O3 MolecularWeight: 282.33372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(CC=O)C(=O)OCC2=CC=CC=C2

InChI

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