(3-octadecanoyloxy-2-oxidanyl-propyl) 3-(2-azanylpropan-2-yl)nonadecanoate

Systemtic Name: (3-octadecanoyloxy-2-oxidanyl-propyl) 3-(2-azanylpropan-2-yl)nonadecanoate Openeye Name: (2-hydroxy-3-octadecanoyloxy-propyl) 3-(1-amino-1-methyl-ethyl)nonadecanoate CAS Name: 3-(2-aminopropan-2-yl)nonadecanoic acid [2-hydroxy-3-(1-oxooctadecoxy)propyl] ester IUPAC Name: (2-hydroxy-3-octadecanoyloxypropyl) 3-(2-aminopropan-2-yl)nonadecanoate Traditional Name: 3-(1-amino-1-methyl-ethyl)nonadecanoic acid (2-hydroxy-3-stearoyloxy-propyl) ester Formula: C43H85NO5 MolecularWeight: 696.1387

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CC(CCCCCCCCCCCCCCCC)C(C)(C)N)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CC(CCCCCCCCCCCCCCCC)C(C)(C)N)O

InChI

InChI=1S/C43H85NO5/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-41(46)48-37-40(45)38-49-42(47)36-39(43(3,4)44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h39-40,45H,5-38,44H2,1-4H3