2-bromoethyl (2-octadecyl-5-oxidanylidene-furan-2-yl)methyl hydrogen phosphate

Systemtic Name: 2-bromoethyl (2-octadecyl-5-oxidanylidene-furan-2-yl)methyl hydrogen phosphate Openeye Name: 2-bromoethyl (2-octadecyl-5-oxo-2-furyl)methyl hydrogen phosphate CAS Name: 2-bromoethyl (2-octadecyl-5-oxo-2-furanyl)methyl hydrogen phosphate IUPAC Name: 2-bromoethyl (2-octadecyl-5-oxofuran-2-yl)methyl hydrogen phosphate Traditional Name: 2-bromoethyl (5-keto-2-stearyl-2-furyl)methyl hydrogen phosphate Formula: C25H46BrO6P MolecularWeight: 553.506901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1(C=CC(=O)O1)COP(=O)(O)OCCBr

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1(C=CC(=O)O1)COP(=O)(O)OCCBr

InChI

InChI=1S/C25H46BrO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-25(20-18-24(27)32-25)23-31-33(28,29)30-22-21-26/h18,20H,2-17,19,21-23H2,1H3,(H,28,29)