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

Systemtic Name: methyl 3-[4-(2-oxidanylidenepropoxy)phenyl]propanoate Openeye Name: methyl 3-(4-acetonyloxyphenyl)propanoate CAS Name: 3-[4-(2-oxopropoxy)phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(2-oxopropoxy)phenyl]propanoate Traditional Name: 3-(4-acetonyloxyphenyl)propionic acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC=C(C=C1)CCC(=O)OC

Isomeric SMILES

CC(=O)COC1=CC=C(C=C1)CCC(=O)OC

InChI

InChI=1S/C13H16O4/c1-10(14)9-17-12-6-3-11(4-7-12)5-8-13(15)16-2/h3-4,6-7H,5,8-9H2,1-2H3