1-[4-octadecan-2-yl-2,5-bis(oxidanyl)phenyl]ethanone

Systemtic Name: 1-[4-octadecan-2-yl-2,5-bis(oxidanyl)phenyl]ethanone Openeye Name: 1-[2,5-dihydroxy-4-(1-methylheptadecyl)phenyl]ethanone CAS Name: 1-(2,5-dihydroxy-4-octadecan-2-ylphenyl)ethanone IUPAC Name: 1-(2,5-dihydroxy-4-octadecan-2-ylphenyl)ethanone Traditional Name: 1-[2,5-dihydroxy-4-(1-methylheptadecyl)phenyl]ethanone Formula: C26H44O3 MolecularWeight: 404.62576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C)C1=C(C=C(C(=C1)O)C(=O)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(C)C1=C(C=C(C(=C1)O)C(=O)C)O

InChI

InChI=1S/C26H44O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(2)23-19-26(29)24(22(3)27)20-25(23)28/h19-21,28-29H,4-18H2,1-3H3