2-[bis(2-methylaziridin-1-yl)phosphorylamino]propyl 12-oxidanyloctadecanoate

Systemtic Name: 2-[bis(2-methylaziridin-1-yl)phosphorylamino]propyl 12-oxidanyloctadecanoate Openeye Name: 2-[bis(2-methylaziridin-1-yl)phosphorylamino]propyl 12-hydroxyoctadecanoate CAS Name: 12-hydroxyoctadecanoic acid 2-[bis(2-methyl-1-aziridinyl)phosphorylamino]propyl ester IUPAC Name: 2-[bis(2-methylaziridin-1-yl)phosphorylamino]propyl 12-hydroxyoctadecanoate Traditional Name: 12-hydroxystearic acid 2-[bis(2-methylethylenimin-1-yl)phosphorylamino]propyl ester Formula: C27H54N3O4P MolecularWeight: 515.709121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCCCCCCC(=O)OCC(C)NP(=O)(N1CC1C)N2CC2C)O

Isomeric SMILES

CCCCCCC(CCCCCCCCCCC(=O)OCC(C)NP(=O)(N1CC1C)N2CC2C)O

InChI

InChI=1S/C27H54N3O4P/c1-5-6-7-14-17-26(31)18-15-12-10-8-9-11-13-16-19-27(32)34-22-23(2)28-35(33,29-20-24(29)3)30-21-25(30)4/h23-26,31H,5-22H2,1-4H3,(H,28,33)