3-[3-[4-(3-azanylpropylamino)butylamino]propyl]-1,1-dioctadecyl-urea

Systemtic Name: 3-[3-[4-(3-azanylpropylamino)butylamino]propyl]-1,1-dioctadecyl-urea Openeye Name: 3-[3-[4-(3-aminopropylamino)butylamino]propyl]-1,1-dioctadecyl-urea CAS Name: 3-[3-[4-(3-aminopropylamino)butylamino]propyl]-1,1-dioctadecylurea IUPAC Name: 3-[3-[4-(3-aminopropylamino)butylamino]propyl]-1,1-dioctadecylurea Traditional Name: 3-[3-[4-(3-aminopropylamino)butylamino]propyl]-1,1-distearyl-urea Formula: C47H99N5O MolecularWeight: 750.32186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)NCCCNCCCCNCCCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C(=O)NCCCNCCCCNCCCN

InChI

InChI=1S/C47H99N5O/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-45-52(47(53)51-44-38-43-50-41-34-33-40-49-42-37-39-48)46-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h49-50H,3-46,48H2,1-2H3,(H,51,53)