1-[6-(2-oxidanylundecylamino)hexylamino]undecan-2-yl phosphono hydrogen phosphate

Systemtic Name: 1-[6-(2-oxidanylundecylamino)hexylamino]undecan-2-yl phosphono hydrogen phosphate Openeye Name: 1-[[6-(2-hydroxyundecylamino)hexylamino]methyl]decyl phosphono hydrogen phosphate CAS Name: 1-[6-(2-hydroxyundecylamino)hexylamino]undecan-2-yl phosphono hydrogen phosphate IUPAC Name: 1-[6-(2-hydroxyundecylamino)hexylamino]undecan-2-yl phosphono hydrogen phosphate Traditional Name: 1-[[6-(2-hydroxyundecylamino)hexylamino]methyl]decyl phosphono hydrogen phosphate Formula: C28H62N2O8P2 MolecularWeight: 616.748002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CNCCCCCCNCC(CCCCCCCCC)OP(=O)(O)OP(=O)(O)O)O

Isomeric SMILES

CCCCCCCCCC(CNCCCCCCNCC(CCCCCCCCC)OP(=O)(O)OP(=O)(O)O)O

InChI

InChI=1S/C28H62N2O8P2/c1-3-5-7-9-11-13-17-21-27(31)25-29-23-19-15-16-20-24-30-26-28(22-18-14-12-10-8-6-4-2)37-40(35,36)38-39(32,33)34/h27-31H,3-26H2,1-2H3,(H,35,36)(H2,32,33,34)