5-(4-hexadecylphenyl)-3,4-dimethyl-5-oxidanyl-furan-2-one

Systemtic Name: 5-(4-hexadecylphenyl)-3,4-dimethyl-5-oxidanyl-furan-2-one Openeye Name: 5-(4-hexadecylphenyl)-5-hydroxy-3,4-dimethyl-furan-2-one CAS Name: 5-(4-hexadecylphenyl)-5-hydroxy-3,4-dimethyl-2-furanone IUPAC Name: 5-(4-hexadecylphenyl)-5-hydroxy-3,4-dimethylfuran-2-one Traditional Name: 5-(4-cetylphenyl)-5-hydroxy-3,4-dimethyl-furan-2-one Formula: C28H44O3 MolecularWeight: 428.64716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)C2(C(=C(C(=O)O2)C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC=C(C=C1)C2(C(=C(C(=O)O2)C)C)O

InChI

InChI=1S/C28H44O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-19-21-26(22-20-25)28(30)24(3)23(2)27(29)31-28/h19-22,30H,4-18H2,1-3H3