[2-(2-dimethylaminoethyloxycarbonylamino)-3-hexadecanoyloxy-propyl] hexadecanoate

Systemtic Name: [2-(2-dimethylaminoethyloxycarbonylamino)-3-hexadecanoyloxy-propyl] hexadecanoate Openeye Name: [2-(2-dimethylaminoethyloxycarbonylamino)-3-hexadecanoyloxy-propyl] hexadecanoate CAS Name: hexadecanoic acid [2-[[2-dimethylaminoethyloxy(oxo)methyl]amino]-3-(1-oxohexadecoxy)propyl] ester IUPAC Name: [2-(2-dimethylaminoethyloxycarbonylamino)-3-hexadecanoyloxypropyl] hexadecanoate Traditional Name: palmitic acid [2-(2-dimethylaminoethyloxycarbonylamino)-3-hexadecanoyloxy-propyl] ester Formula: C40H78N2O6 MolecularWeight: 683.05712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)NC(=O)OCCN(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)NC(=O)OCCN(C)C

InChI

InChI=1S/C40H78N2O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-38(43)47-35-37(41-40(45)46-34-33-42(3)4)36-48-39(44)32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h37H,5-36H2,1-4H3,(H,41,45)