octadecyl 2-oxidanyl-4-phenyl-butanoate

Systemtic Name: octadecyl 2-oxidanyl-4-phenyl-butanoate Openeye Name: octadecyl 2-hydroxy-4-phenyl-butanoate CAS Name: 2-hydroxy-4-phenylbutanoic acid octadecyl ester IUPAC Name: octadecyl 2-hydroxy-4-phenylbutanoate Traditional Name: 2-hydroxy-4-phenyl-butyric acid stearyl ester Formula: C28H48O3 MolecularWeight: 432.67892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(CCC1=CC=CC=C1)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(CCC1=CC=CC=C1)O

InChI

InChI=1S/C28H48O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-25-31-28(30)27(29)24-23-26-21-18-17-19-22-26/h17-19,21-22,27,29H,2-16,20,23-25H2,1H3