[1-azanyl-7-[bis(azanyl)methylideneamino]-1-oxidanylidene-heptan-3-yl] tetradecanoate

Systemtic Name: [1-azanyl-7-[bis(azanyl)methylideneamino]-1-oxidanylidene-heptan-3-yl] tetradecanoate Openeye Name: [1-(2-amino-2-oxo-ethyl)-5-guanidino-pentyl] tetradecanoate CAS Name: tetradecanoic acid [1-amino-7-(diaminomethylideneamino)-1-oxoheptan-3-yl] ester IUPAC Name: [1-amino-7-(diaminomethylideneamino)-1-oxoheptan-3-yl] tetradecanoate Traditional Name: myristic acid [1-(2-amino-2-keto-ethyl)-5-guanidino-pentyl] ester Formula: C22H44N4O3 MolecularWeight: 412.60976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OC(CCCCN=C(N)N)CC(=O)N

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OC(CCCCN=C(N)N)CC(=O)N

InChI

InChI=1S/C22H44N4O3/c1-2-3-4-5-6-7-8-9-10-11-12-16-21(28)29-19(18-20(23)27)15-13-14-17-26-22(24)25/h19H,2-18H2,1H3,(H2,23,27)(H4,24,25,26)