3-[1,2,2-tris[2,3-bis(oxidanyl)propyl]-1,4,8,11-tetrazacyclohexadec-3-yl]propane-1,2-diol

Systemtic Name: 3-[1,2,2-tris[2,3-bis(oxidanyl)propyl]-1,4,8,11-tetrazacyclohexadec-3-yl]propane-1,2-diol Openeye Name: 3-[1,2,2-tris(2,3-dihydroxypropyl)-1,4,8,11-tetrazacyclohexadec-3-yl]propane-1,2-diol CAS Name: 3-[1,2,2-tris(2,3-dihydroxypropyl)-1,4,8,11-tetrazacyclohexadec-3-yl]propane-1,2-diol IUPAC Name: 3-[1,2,2-tris(2,3-dihydroxypropyl)-1,4,8,11-tetrazacyclohexadec-3-yl]propane-1,2-diol Traditional Name: 3-(1,2,2-triglyceryl-1,4,8,11-tetrazacyclohexadec-3-yl)propane-1,2-diol Formula: C24H52N4O8 MolecularWeight: 524.69168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNCCNCCCNC(C(N(CC1)CC(CO)O)(CC(CO)O)CC(CO)O)CC(CO)O

Isomeric SMILES

C1CCNCCNCCCNC(C(N(CC1)CC(CO)O)(CC(CO)O)CC(CO)O)CC(CO)O

InChI

InChI=1S/C24H52N4O8/c29-15-19(33)11-23-24(12-20(34)16-30,13-21(35)17-31)28(14-22(36)18-32)10-3-1-2-5-25-8-9-26-6-4-7-27-23/h19-23,25-27,29-36H,1-18H2