3-oxidanyl-2-(3-phenylpropyl)hexanoate

Systemtic Name: 3-oxidanyl-2-(3-phenylpropyl)hexanoate Openeye Name: 3-hydroxy-2-(3-phenylpropyl)hexanoate CAS Name: 3-hydroxy-2-(3-phenylpropyl)hexanoate IUPAC Name: 3-hydroxy-2-(3-phenylpropyl)hexanoate Traditional Name: 3-hydroxy-2-(3-phenylpropyl)hexanoate Formula: C15H21O3- MolecularWeight: 249.32544

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CCCC1=CC=CC=C1)C(=O)[O-])O

Isomeric SMILES

CCCC(C(CCCC1=CC=CC=C1)C(=O)[O-])O

InChI

InChI=1S/C15H22O3/c1-2-7-14(16)13(15(17)18)11-6-10-12-8-4-3-5-9-12/h3-5,8-9,13-14,16H,2,6-7,10-11H2,1H3,(H,17,18)/p-1