bis[(4-bromanyl-3-methyl-3-oxidanyl-butoxy)-oxidanyl-phosphoryl] hydrogen phosphate

Systemtic Name: bis[(4-bromanyl-3-methyl-3-oxidanyl-butoxy)-oxidanyl-phosphoryl] hydrogen phosphate Openeye Name: bis[(4-bromo-3-hydroxy-3-methyl-butoxy)-hydroxy-phosphoryl] hydrogen phosphate CAS Name: bis[(4-bromo-3-hydroxy-3-methylbutoxy)-hydroxyphosphoryl] hydrogen phosphate IUPAC Name: bis[(4-bromo-3-hydroxy-3-methylbutoxy)-hydroxyphosphoryl] hydrogen phosphate Traditional Name: bis[(4-bromo-3-hydroxy-3-methyl-butoxy)-hydroxy-phosphoryl] hydrogen phosphate Formula: C10H23Br2O12P3 MolecularWeight: 588.011703

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOP(=O)(O)OP(=O)(O)OP(=O)(O)OCCC(C)(CBr)O)(CBr)O

Isomeric SMILES

CC(CCOP(=O)(O)OP(=O)(O)OP(=O)(O)OCCC(C)(CBr)O)(CBr)O

InChI

InChI=1S/C10H23Br2O12P3/c1-9(13,7-11)3-5-21-25(15,16)23-27(19,20)24-26(17,18)22-6-4-10(2,14)8-12/h13-14H,3-8H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)