pentatriacontan-18-yl N-[2-[[2-azanyl-5-(3-azanylpropylamino)pentanoyl]amino]ethyl]carbamate

Systemtic Name: pentatriacontan-18-yl N-[2-[[2-azanyl-5-(3-azanylpropylamino)pentanoyl]amino]ethyl]carbamate Openeye Name: 1-heptadecyloctadecyl N-[2-[[2-amino-5-(3-aminopropylamino)pentanoyl]amino]ethyl]carbamate CAS Name: N-[2-[[2-amino-5-(3-aminopropylamino)-1-oxopentyl]amino]ethyl]carbamic acid pentatriacontan-18-yl ester IUPAC Name: pentatriacontan-18-yl N-[2-[[2-amino-5-(3-aminopropylamino)pentanoyl]amino]ethyl]carbamate Traditional Name: N-[2-[[2-amino-5-(3-aminopropylamino)pentanoyl]amino]ethyl]carbamic acid 1-heptadecyloctadecyl ester Formula: C46H95N5O3 MolecularWeight: 766.2782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCC)OC(=O)NCCNC(=O)C(CCCNCCCN)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCC)OC(=O)NCCNC(=O)C(CCCNCCCN)N

InChI

InChI=1S/C46H95N5O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-43(36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)54-46(53)51-42-41-50-45(52)44(48)37-33-39-49-40-34-38-47/h43-44,49H,3-42,47-48H2,1-2H3,(H,50,52)(H,51,53)