phenacyl (3S)-3-oxidanyltetradecanoate

Systemtic Name: phenacyl (3S)-3-oxidanyltetradecanoate Openeye Name: phenacyl (3S)-3-hydroxytetradecanoate CAS Name: (3S)-3-hydroxytetradecanoic acid phenacyl ester IUPAC Name: phenacyl (3S)-3-hydroxytetradecanoate Traditional Name: (3S)-3-hydroxymyristic acid phenacyl ester Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)OCC(=O)C1=CC=CC=C1)O

Isomeric SMILES

CCCCCCCCCCC[C@@H](CC(=O)OCC(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C22H34O4/c1-2-3-4-5-6-7-8-9-13-16-20(23)17-22(25)26-18-21(24)19-14-11-10-12-15-19/h10-12,14-15,20,23H,2-9,13,16-18H2,1H3/t20-/m0/s1