methyl 5-methyl-2-(2-oxidanylidenepropyl)benzoate

Systemtic Name: methyl 5-methyl-2-(2-oxidanylidenepropyl)benzoate Openeye Name: methyl 2-acetonyl-5-methyl-benzoate CAS Name: 5-methyl-2-(2-oxopropyl)benzoic acid methyl ester IUPAC Name: methyl 5-methyl-2-(2-oxopropyl)benzoate Traditional Name: 2-acetonyl-5-methyl-benzoic acid methyl ester Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O3/c1-8-4-5-10(7-9(2)13)11(6-8)12(14)15-3/h4-6H,7H2,1-3H3