(phenylmethyl) 3-(4-tert-butylphenyl)-2-oxidanylidene-propanoate

Systemtic Name: (phenylmethyl) 3-(4-tert-butylphenyl)-2-oxidanylidene-propanoate Openeye Name: benzyl 3-(4-tert-butylphenyl)-2-oxo-propanoate CAS Name: 3-(4-tert-butylphenyl)-2-oxopropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(4-tert-butylphenyl)-2-oxopropanoate Traditional Name: 3-(4-tert-butylphenyl)-2-keto-propionic acid benzyl ester Formula: C20H22O3 MolecularWeight: 310.38688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22O3/c1-20(2,3)17-11-9-15(10-12-17)13-18(21)19(22)23-14-16-7-5-4-6-8-16/h4-12H,13-14H2,1-3H3