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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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