methyl 2-[4-(2-oxidanylidenepropyl)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(2-oxidanylidenepropyl)phenyl]ethanoate Openeye Name: methyl 2-(4-acetonylphenyl)acetate CAS Name: 2-[4-(2-oxopropyl)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(2-oxopropyl)phenyl]acetate Traditional Name: 2-(4-acetonylphenyl)acetic acid methyl ester Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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