methyl 3-[4-[3-(3-oxidanylidenepropyl)phenyl]butyl]benzoate

Systemtic Name: methyl 3-[4-[3-(3-oxidanylidenepropyl)phenyl]butyl]benzoate Openeye Name: methyl 3-[4-[3-(3-oxopropyl)phenyl]butyl]benzoate CAS Name: 3-[4-[3-(3-oxopropyl)phenyl]butyl]benzoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(3-oxopropyl)phenyl]butyl]benzoate Traditional Name: 3-[4-[3-(3-ketopropyl)phenyl]butyl]benzoic acid methyl ester Formula: C21H24O3 MolecularWeight: 324.41346

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CCCCC2=CC=CC(=C2)CCC=O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CCCCC2=CC=CC(=C2)CCC=O

InChI

InChI=1S/C21H24O3/c1-24-21(23)20-13-5-11-19(16-20)8-3-2-7-17-9-4-10-18(15-17)12-6-14-22/h4-5,9-11,13-16H,2-3,6-8,12H2,1H3