N1-[4-(3-azanylpropylamino)butyl]-N3,N3,3-trihexadecyl-nonadecane-1,3-diamine

Systemtic Name: N1-[4-(3-azanylpropylamino)butyl]-N3,N3,3-trihexadecyl-nonadecane-1,3-diamine Openeye Name: N1-[4-(3-aminopropylamino)butyl]-N3,N3,3-trihexadecyl-nonadecane-1,3-diamine CAS Name: N1-[4-(3-aminopropylamino)butyl]-N3,N3,3-trihexadecylnonadecane-1,3-diamine IUPAC Name: 1-N-[4-(3-aminopropylamino)butyl]-3-N,3-N,3-trihexadecylnonadecane-1,3-diamine Traditional Name: [1-[2-[4-(3-aminopropylamino)butylamino]ethyl]-1-cetyl-heptadecyl]-dicetyl-amine Formula: C74H154N4 MolecularWeight: 1100.04136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)(CCNCCCCNCCCN)N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)(CCNCCCCNCCCN)N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC

InChI

InChI=1S/C74H154N4/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-64-74(66-71-77-69-60-59-68-76-70-63-67-75,65-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2)78(72-61-55-51-47-43-39-35-31-27-23-19-15-11-7-3)73-62-56-52-48-44-40-36-32-28-24-20-16-12-8-4/h76-77H,5-73,75H2,1-4H3