bis(4-octadecyl-2-oxidanyl-phenyl)methanone

Systemtic Name: bis(4-octadecyl-2-oxidanyl-phenyl)methanone Openeye Name: bis(2-hydroxy-4-octadecyl-phenyl)methanone CAS Name: bis(2-hydroxy-4-octadecylphenyl)methanone IUPAC Name: bis(2-hydroxy-4-octadecylphenyl)methanone Traditional Name: bis(2-hydroxy-4-stearyl-phenyl)methanone Formula: C49H82O3 MolecularWeight: 719.17358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)CCCCCCCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)CCCCCCCCCCCCCCCCCC)O)O

InChI

InChI=1S/C49H82O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-43-37-39-45(47(50)41-43)49(52)46-40-38-44(42-48(46)51)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37-42,50-51H,3-36H2,1-2H3