methyl 4-methyl-2-(2-oxidanylidenepropyl)benzoate

Systemtic Name: methyl 4-methyl-2-(2-oxidanylidenepropyl)benzoate Openeye Name: methyl 2-acetonyl-4-methyl-benzoate CAS Name: 4-methyl-2-(2-oxopropyl)benzoic acid methyl ester IUPAC Name: methyl 4-methyl-2-(2-oxopropyl)benzoate Traditional Name: 2-acetonyl-4-methyl-benzoic acid methyl ester Formula: C12H14O3 MolecularWeight: 206.23776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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