[(2S)-1-octadecanoylaziridin-2-yl]methyl butanoate

Systemtic Name: [(2S)-1-octadecanoylaziridin-2-yl]methyl butanoate Openeye Name: [(2S)-1-octadecanoylaziridin-2-yl]methyl butanoate CAS Name: butanoic acid [(2S)-1-(1-oxooctadecyl)-2-aziridinyl]methyl ester IUPAC Name: [(2S)-1-octadecanoylaziridin-2-yl]methyl butanoate Traditional Name: butyric acid [(2S)-1-stearoylethylenimin-2-yl]methyl ester Formula: C25H47NO3 MolecularWeight: 409.64558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)N1CC1COC(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N1C[C@H]1COC(=O)CCC

InChI

InChI=1S/C25H47NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-24(27)26-21-23(26)22-29-25(28)19-4-2/h23H,3-22H2,1-2H3/t23-,26?/m0/s1