N-[2-[2-[bis(3-azanyl-3-oxidanylidene-propyl)amino]ethyl-octadecanoyl-amino]ethyl]octadecanamide

Systemtic Name: N-[2-[2-[bis(3-azanyl-3-oxidanylidene-propyl)amino]ethyl-octadecanoyl-amino]ethyl]octadecanamide Openeye Name: N-[2-[2-[bis(3-amino-3-oxo-propyl)amino]ethyl-octadecanoyl-amino]ethyl]octadecanamide CAS Name: N-[2-[2-[bis(3-amino-3-oxopropyl)amino]ethyl-(1-oxooctadecyl)amino]ethyl]octadecanamide IUPAC Name: N-[2-[2-[bis(3-amino-3-oxopropyl)amino]ethyl-octadecanoylamino]ethyl]octadecanamide Traditional Name: N-[2-[2-[bis(3-amino-3-keto-propyl)amino]ethyl-stearoyl-amino]ethyl]stearamide Formula: C46H91N5O4 MolecularWeight: 778.24584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCN(CCN(CCC(=O)N)CCC(=O)N)C(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCN(CCN(CCC(=O)N)CCC(=O)N)C(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C46H91N5O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-45(54)49-37-40-51(42-41-50(38-35-43(47)52)39-36-44(48)53)46(55)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-42H2,1-2H3,(H2,47,52)(H2,48,53)(H,49,54)