[4-azanyl-7-[bis(azanyl)methylideneamino]-1-(didecylamino)heptyl] ethanoate

Systemtic Name: [4-azanyl-7-[bis(azanyl)methylideneamino]-1-(didecylamino)heptyl] ethanoate Openeye Name: [4-amino-1-(didecylamino)-7-guanidino-heptyl] acetate CAS Name: acetic acid [4-amino-7-(diaminomethylideneamino)-1-(didecylamino)heptyl] ester IUPAC Name: [4-amino-7-(diaminomethylideneamino)-1-(didecylamino)heptyl] acetate Traditional Name: acetic acid [4-amino-1-(didecylamino)-7-guanidino-heptyl] ester Formula: C30H63N5O2 MolecularWeight: 525.85352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN(CCCCCCCCCC)C(CCC(CCCN=C(N)N)N)OC(=O)C

Isomeric SMILES

CCCCCCCCCCN(CCCCCCCCCC)C(CCC(CCCN=C(N)N)N)OC(=O)C

InChI

InChI=1S/C30H63N5O2/c1-4-6-8-10-12-14-16-18-25-35(26-19-17-15-13-11-9-7-5-2)29(37-27(3)36)23-22-28(31)21-20-24-34-30(32)33/h28-29H,4-26,31H2,1-3H3,(H4,32,33,34)