[2-azanyl-3-(octadecylamino)-3-oxidanylidene-propyl] 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: [2-azanyl-3-(octadecylamino)-3-oxidanylidene-propyl] 2,2,2-tris(fluoranyl)ethanoate Openeye Name: [2-amino-3-(octadecylamino)-3-oxo-propyl] 2,2,2-trifluoroacetate CAS Name: 2,2,2-trifluoroacetic acid [2-amino-3-(octadecylamino)-3-oxopropyl] ester IUPAC Name: [2-amino-3-(octadecylamino)-3-oxopropyl] 2,2,2-trifluoroacetate Traditional Name: 2,2,2-trifluoroacetic acid [2-amino-3-keto-3-(stearylamino)propyl] ester Formula: C23H43F3N2O3 MolecularWeight: 452.59433

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(COC(=O)C(F)(F)F)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C(COC(=O)C(F)(F)F)N

InChI

InChI=1S/C23H43F3N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-21(29)20(27)19-31-22(30)23(24,25)26/h20H,2-19,27H2,1H3,(H,28,29)