3-phenylpropyl hexanoate

Systemtic Name: 3-phenylpropyl hexanoate Openeye Name: 3-phenylpropyl hexanoate CAS Name: hexanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl hexanoate Traditional Name: hexanoic acid 3-phenylpropyl ester Formula: C15H22O2 MolecularWeight: 234.33398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCCCC1=CC=CC=C1

Isomeric SMILES

CCCCCC(=O)OCCCC1=CC=CC=C1

InChI

InChI=1S/C15H22O2/c1-2-3-5-12-15(16)17-13-8-11-14-9-6-4-7-10-14/h4,6-7,9-10H,2-3,5,8,11-13H2,1H3