(3-chloranyl-1-phenyl-propyl) butanoate

Systemtic Name: (3-chloranyl-1-phenyl-propyl) butanoate Openeye Name: (3-chloro-1-phenyl-propyl) butanoate CAS Name: butanoic acid (3-chloro-1-phenylpropyl) ester IUPAC Name: (3-chloro-1-phenylpropyl) butanoate Traditional Name: butyric acid (3-chloro-1-phenyl-propyl) ester Formula: C13H17ClO2 MolecularWeight: 240.72588

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(CCCl)C1=CC=CC=C1

Isomeric SMILES

CCCC(=O)OC(CCCl)C1=CC=CC=C1

InChI

InChI=1S/C13H17ClO2/c1-2-6-13(15)16-12(9-10-14)11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9-10H2,1H3