(4-methylphenyl)methyl 3-oxidanylidenebutanoate

Systemtic Name: (4-methylphenyl)methyl 3-oxidanylidenebutanoate Openeye Name: p-tolylmethyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid (4-methylbenzyl) ester Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)CC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)CC(=O)C

InChI

InChI=1S/C12H14O3/c1-9-3-5-11(6-4-9)8-15-12(14)7-10(2)13/h3-6H,7-8H2,1-2H3