1-[1-[bis(2-oxidanyl-3-phenoxy-propyl)amino]propan-2-yl-octadecyl-amino]-3-phenoxy-propan-2-ol

Systemtic Name: 1-[1-[bis(2-oxidanyl-3-phenoxy-propyl)amino]propan-2-yl-octadecyl-amino]-3-phenoxy-propan-2-ol Openeye Name: 1-[[2-[bis(2-hydroxy-3-phenoxy-propyl)amino]-1-methyl-ethyl]-octadecyl-amino]-3-phenoxy-propan-2-ol CAS Name: 1-[1-[bis(2-hydroxy-3-phenoxypropyl)amino]propan-2-yl-octadecylamino]-3-phenoxy-2-propanol IUPAC Name: 1-[1-[bis(2-hydroxy-3-phenoxypropyl)amino]propan-2-yl-octadecylamino]-3-phenoxypropan-2-ol Traditional Name: 1-[[2-[bis(2-hydroxy-3-phenoxy-propyl)amino]-1-methyl-ethyl]-stearyl-amino]-3-phenoxy-propan-2-ol Formula: C48H76N2O6 MolecularWeight: 777.12684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CC(COC1=CC=CC=C1)O)C(C)CN(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CC(COC1=CC=CC=C1)O)C(C)CN(CC(COC2=CC=CC=C2)O)CC(COC3=CC=CC=C3)O

InChI

InChI=1S/C48H76N2O6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27-34-50(38-45(53)41-56-48-32-25-20-26-33-48)42(2)35-49(36-43(51)39-54-46-28-21-18-22-29-46)37-44(52)40-55-47-30-23-19-24-31-47/h18-26,28-33,42-45,51-53H,3-17,27,34-41H2,1-2H3