(3-bromanyl-5-octadecyl-4-oxidanyl-phenyl)phosphonic acid

Systemtic Name: (3-bromanyl-5-octadecyl-4-oxidanyl-phenyl)phosphonic acid Openeye Name: (3-bromo-4-hydroxy-5-octadecyl-phenyl)phosphonic acid CAS Name: (3-bromo-4-hydroxy-5-octadecylphenyl)phosphonic acid IUPAC Name: (3-bromo-4-hydroxy-5-octadecylphenyl)phosphonic acid Traditional Name: (3-bromo-4-hydroxy-5-stearyl-phenyl)phosphonic acid Formula: C24H42BrO4P MolecularWeight: 505.465641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC(=CC(=C1O)Br)P(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC(=CC(=C1O)Br)P(=O)(O)O

InChI

InChI=1S/C24H42BrO4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19-22(30(27,28)29)20-23(25)24(21)26/h19-20,26H,2-18H2,1H3,(H2,27,28,29)