[(2S)-2-oxidanyl-3-phenylmethoxy-propyl] octanoate

Systemtic Name: [(2S)-2-oxidanyl-3-phenylmethoxy-propyl] octanoate Openeye Name: [(2S)-3-benzyloxy-2-hydroxy-propyl] octanoate CAS Name: octanoic acid [(2S)-2-hydroxy-3-phenylmethoxypropyl] ester IUPAC Name: [(2S)-2-hydroxy-3-phenylmethoxypropyl] octanoate Traditional Name: caprylic acid [(2S)-3-benzoxy-2-hydroxy-propyl] ester Formula: C18H28O4 MolecularWeight: 308.41252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC(COCC1=CC=CC=C1)O

Isomeric SMILES

CCCCCCCC(=O)OC[C@H](COCC1=CC=CC=C1)O

InChI

InChI=1S/C18H28O4/c1-2-3-4-5-9-12-18(20)22-15-17(19)14-21-13-16-10-7-6-8-11-16/h6-8,10-11,17,19H,2-5,9,12-15H2,1H3/t17-/m0/s1