(2R)-2-dodecyl-6-oxidanyl-6-(phenylmethoxymethyl)pyran-3-one

Systemtic Name: (2R)-2-dodecyl-6-oxidanyl-6-(phenylmethoxymethyl)pyran-3-one Openeye Name: (2R)-6-(benzyloxymethyl)-2-dodecyl-6-hydroxy-pyran-3-one CAS Name: (2R)-2-dodecyl-6-hydroxy-6-(phenylmethoxymethyl)-3-pyranone IUPAC Name: (2R)-2-dodecyl-6-hydroxy-6-(phenylmethoxymethyl)pyran-3-one Traditional Name: (2R)-6-(benzoxymethyl)-6-hydroxy-2-lauryl-pyran-3-one Formula: C25H38O4 MolecularWeight: 402.56682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1C(=O)C=CC(O1)(COCC2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCC[C@@H]1C(=O)C=CC(O1)(COCC2=CC=CC=C2)O

InChI

InChI=1S/C25H38O4/c1-2-3-4-5-6-7-8-9-10-14-17-24-23(26)18-19-25(27,29-24)21-28-20-22-15-12-11-13-16-22/h11-13,15-16,18-19,24,27H,2-10,14,17,20-21H2,1H3/t24-,25?/m1/s1