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

Systemtic Name: (3-chloranyl-1-phenyl-propyl) pentanoate Openeye Name: (3-chloro-1-phenyl-propyl) pentanoate CAS Name: pentanoic acid (3-chloro-1-phenylpropyl) ester IUPAC Name: (3-chloro-1-phenylpropyl) pentanoate Traditional Name: valeric acid (3-chloro-1-phenyl-propyl) ester Formula: C14H19ClO2 MolecularWeight: 254.75246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClO2/c1-2-3-9-14(16)17-13(10-11-15)12-7-5-4-6-8-12/h4-8,13H,2-3,9-11H2,1H3