methyl 3-(4-oxidanylidenepentyl)benzoate

Systemtic Name: methyl 3-(4-oxidanylidenepentyl)benzoate Openeye Name: methyl 3-(4-oxopentyl)benzoate CAS Name: 3-(4-oxopentyl)benzoic acid methyl ester IUPAC Name: methyl 3-(4-oxopentyl)benzoate Traditional Name: 3-(4-ketopentyl)benzoic acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCC1=CC=CC(=C1)C(=O)OC

Isomeric SMILES

CC(=O)CCCC1=CC=CC(=C1)C(=O)OC

InChI

InChI=1S/C13H16O3/c1-10(14)5-3-6-11-7-4-8-12(9-11)13(15)16-2/h4,7-9H,3,5-6H2,1-2H3