dodecyl-[4-[[4-[1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-oxidanyl-propyl]-4-oxidanylidene-azetidin-2-yl]phenyl]methylamino]-4-oxidanylidene-butyl]-dimethyl-azanium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: dodecyl-[4-[[4-[1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-oxidanyl-propyl]-4-oxidanylidene-azetidin-2-yl]phenyl]methylamino]-4-oxidanylidene-butyl]-dimethyl-azanium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: dodecyl-[4-[[4-[1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-hydroxy-propyl]-4-oxo-azetidin-2-yl]phenyl]methylamino]-4-oxo-butyl]-dimethyl-ammonium; 2,2,2-trifluoroacetate CAS Name: dodecyl-[4-[[4-[1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-hydroxypropyl]-4-oxo-2-azetidinyl]phenyl]methylamino]-4-oxobutyl]-dimethylammonium; 2,2,2-trifluoroacetate IUPAC Name: dodecyl-[4-[[4-[1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-hydroxypropyl]-4-oxoazetidin-2-yl]phenyl]methylamino]-4-oxobutyl]-dimethylazanium; 2,2,2-trifluoroacetate Traditional Name: [4-[[4-[1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-hydroxy-propyl]-4-keto-azetidin-2-yl]benzyl]amino]-4-keto-butyl]-lauryl-dimethyl-ammonium; 2,2,2-trifluoroacetate Formula: C45H60F5N3O5 MolecularWeight: 817.967016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CCCC(=O)NCC1=CC=C(C=C1)C2C(C(=O)N2C3=CC=C(C=C3)F)CCC(C4=CC=C(C=C4)F)O.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CCCC(=O)NCC1=CC=C(C=C1)C2C(C(=O)N2C3=CC=C(C=C3)F)CCC(C4=CC=C(C=C4)F)O.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C43H59F2N3O3.C2HF3O2/c1-4-5-6-7-8-9-10-11-12-13-30-48(2,3)31-14-15-41(50)46-32-33-16-18-35(19-17-33)42-39(28-29-40(49)34-20-22-36(44)23-21-34)43(51)47(42)38-26-24-37(45)25-27-38;3-2(4,5)1(6)7/h16-27,39-40,42,49H,4-15,28-32H2,1-3H3;(H,6,7)