methyl 3-[4-(2-oxidanylidenepropyl)phenyl]propanoate

Systemtic Name: methyl 3-[4-(2-oxidanylidenepropyl)phenyl]propanoate Openeye Name: methyl 3-(4-acetonylphenyl)propanoate CAS Name: 3-[4-(2-oxopropyl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(2-oxopropyl)phenyl]propanoate Traditional Name: 3-(4-acetonylphenyl)propionic acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O3/c1-10(14)9-12-5-3-11(4-6-12)7-8-13(15)16-2/h3-6H,7-9H2,1-2H3