1-[[4-[(dioctadecylamino)methyl]phenyl]methylamino]-2-(hydroxymethyl)propane-1,3-diol

Systemtic Name: 1-[[4-[(dioctadecylamino)methyl]phenyl]methylamino]-2-(hydroxymethyl)propane-1,3-diol Openeye Name: 1-[[4-[(dioctadecylamino)methyl]phenyl]methylamino]-2-(hydroxymethyl)propane-1,3-diol CAS Name: 1-[[4-[(dioctadecylamino)methyl]phenyl]methylamino]-2-(hydroxymethyl)propane-1,3-diol IUPAC Name: 1-[[4-[(dioctadecylamino)methyl]phenyl]methylamino]-2-(hydroxymethyl)propane-1,3-diol Traditional Name: 1-[[4-[(distearylamino)methyl]benzyl]amino]-2-methylol-propane-1,3-diol Formula: C48H92N2O3 MolecularWeight: 745.25568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)CC1=CC=C(C=C1)CNC(C(CO)CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)CC1=CC=C(C=C1)CNC(C(CO)CO)O

InChI

InChI=1S/C48H92N2O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-50(42-46-37-35-45(36-38-46)41-49-48(53)47(43-51)44-52)40-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-38,47-49,51-53H,3-34,39-44H2,1-2H3