3-phenylpropyl octanoate

Systemtic Name: 3-phenylpropyl octanoate Openeye Name: 3-phenylpropyl octanoate CAS Name: octanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl octanoate Traditional Name: caprylic acid 3-phenylpropyl ester Formula: C17H26O2 MolecularWeight: 262.38714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCCCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCC(=O)OCCCC1=CC=CC=C1

InChI

InChI=1S/C17H26O2/c1-2-3-4-5-9-14-17(18)19-15-10-13-16-11-7-6-8-12-16/h6-8,11-12H,2-5,9-10,13-15H2,1H3