methyl 3-(4-oxidanylidenebutyl)benzoate

Systemtic Name: methyl 3-(4-oxidanylidenebutyl)benzoate Openeye Name: methyl 3-(4-oxobutyl)benzoate CAS Name: 3-(4-oxobutyl)benzoic acid methyl ester IUPAC Name: methyl 3-(4-oxobutyl)benzoate Traditional Name: 3-(4-ketobutyl)benzoic acid methyl ester Formula: C12H14O3 MolecularWeight: 206.23776

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CCCC=O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CCCC=O

InChI

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