hexyl (3R)-3-phenylbutanoate

Systemtic Name: hexyl (3R)-3-phenylbutanoate Openeye Name: hexyl (3R)-3-phenylbutanoate CAS Name: (3R)-3-phenylbutanoic acid hexyl ester IUPAC Name: hexyl (3R)-3-phenylbutanoate Traditional Name: (3R)-3-phenylbutyric acid hexyl ester Formula: C16H24O2 MolecularWeight: 248.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC(C)C1=CC=CC=C1

Isomeric SMILES

CCCCCCOC(=O)C[C@@H](C)C1=CC=CC=C1

InChI

InChI=1S/C16H24O2/c1-3-4-5-9-12-18-16(17)13-14(2)15-10-7-6-8-11-15/h6-8,10-11,14H,3-5,9,12-13H2,1-2H3/t14-/m1/s1