methyl 2-[4-(2-methylpropyl)phenyl]-2-oxidanylidene-ethanoate

Systemtic Name: methyl 2-[4-(2-methylpropyl)phenyl]-2-oxidanylidene-ethanoate Openeye Name: methyl 2-(4-isobutylphenyl)-2-oxo-acetate CAS Name: 2-[4-(2-methylpropyl)phenyl]-2-oxoacetic acid methyl ester IUPAC Name: methyl 2-[4-(2-methylpropyl)phenyl]-2-oxoacetate Traditional Name: 2-(4-isobutylphenyl)-2-keto-acetic acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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