octyl 4-phenylbutanoate

Systemtic Name: octyl 4-phenylbutanoate Openeye Name: octyl 4-phenylbutanoate CAS Name: 4-phenylbutanoic acid octyl ester IUPAC Name: octyl 4-phenylbutanoate Traditional Name: 4-phenylbutyric acid octyl ester Formula: C18H28O2 MolecularWeight: 276.41372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCOC(=O)CCCC1=CC=CC=C1

InChI

InChI=1S/C18H28O2/c1-2-3-4-5-6-10-16-20-18(19)15-11-14-17-12-8-7-9-13-17/h7-9,12-13H,2-6,10-11,14-16H2,1H3