dioctadecyl 7-[5-(aminocarbonylcarbamoylamino)pentyl]nonadecanedioate

Systemtic Name: dioctadecyl 7-[5-(aminocarbonylcarbamoylamino)pentyl]nonadecanedioate Openeye Name: dioctadecyl 7-[5-(allophanoylamino)pentyl]nonadecanedioate CAS Name: 7-[5-[[(carbamoylamino)-oxomethyl]amino]pentyl]nonadecanedioic acid dioctadecyl ester IUPAC Name: dioctadecyl 7-[5-(carbamoylcarbamoylamino)pentyl]nonadecanedioate Traditional Name: 7-[5-(allophanoylamino)pentyl]nonadecanedioic acid distearyl ester Formula: C62H121N3O6 MolecularWeight: 1004.64064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCC(CCCCCC(=O)OCCCCCCCCCCCCCCCCCC)CCCCCNC(=O)NC(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCC(CCCCCC(=O)OCCCCCCCCCCCCCCCCCC)CCCCCNC(=O)NC(=O)N

InChI

InChI=1S/C62H121N3O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-30-34-38-48-56-70-59(66)53-45-37-33-29-27-28-32-36-42-50-58(52-44-41-47-55-64-62(69)65-61(63)68)51-43-40-46-54-60(67)71-57-49-39-35-31-26-24-22-20-18-16-14-12-10-8-6-4-2/h58H,3-57H2,1-2H3,(H4,63,64,65,68,69)