2-[[6-azanyl-2-[bis(azanyl)methylideneamino]-2-methyl-hexanoyl]amino]ethyl-methyl-di(tetradecyl)azanium

Systemtic Name: 2-[[6-azanyl-2-[bis(azanyl)methylideneamino]-2-methyl-hexanoyl]amino]ethyl-methyl-di(tetradecyl)azanium Openeye Name: 2-[(6-amino-2-guanidino-2-methyl-hexanoyl)amino]ethyl-methyl-di(tetradecyl)ammonium CAS Name: 2-[[6-amino-2-(diaminomethylideneamino)-2-methyl-1-oxohexyl]amino]ethyl-methyl-di(tetradecyl)ammonium IUPAC Name: 2-[[6-amino-2-(diaminomethylideneamino)-2-methylhexanoyl]amino]ethyl-methyl-di(tetradecyl)azanium Traditional Name: 2-[(6-amino-2-guanidino-2-methyl-hexanoyl)amino]ethyl-methyl-dimyristyl-ammonium Formula: C39H83N6O+ MolecularWeight: 652.11592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCC)CCNC(=O)C(C)(CCCCN)N=C(N)N

Isomeric SMILES

CCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCC)CCNC(=O)C(C)(CCCCN)N=C(N)N

InChI

InChI=1S/C39H82N6O/c1-5-7-9-11-13-15-17-19-21-23-25-29-34-45(4,35-30-26-24-22-20-18-16-14-12-10-8-6-2)36-33-43-37(46)39(3,44-38(41)42)31-27-28-32-40/h5-36,40H2,1-4H3,(H4-,41,42,43,44,46)/p+1