[6-[4-[1-[[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylamino]cyclopentyl]carbonylpiperazin-1-yl]-6-oxidanylidene-hexyl]-trimethyl-azanium; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: [6-[4-[1-[[2,4-bis(chloranyl)-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylamino]cyclopentyl]carbonylpiperazin-1-yl]-6-oxidanylidene-hexyl]-trimethyl-azanium; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: [6-[4-[1-[[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonylamino]cyclopentanecarbonyl]piperazin-1-yl]-6-oxo-hexyl]-trimethyl-ammonium; 2,2,2-trifluoroacetic acid CAS Name: [6-[4-[[1-[[2,4-dichloro-3-[(2,4-dimethyl-8-quinolinyl)oxymethyl]phenyl]sulfonylamino]cyclopentyl]-oxomethyl]-1-piperazinyl]-6-oxohexyl]-trimethylammonium; 2,2,2-trifluoroacetic acid IUPAC Name: [6-[4-[1-[[2,4-dichloro-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylamino]cyclopentanecarbonyl]piperazin-1-yl]-6-oxohexyl]-trimethylazanium; 2,2,2-trifluoroacetic acid Traditional Name: [6-[4-[1-[[2,4-dichloro-3-[(2,4-dimethyl-8-quinolyl)oxymethyl]phenyl]sulfonylamino]cyclopentanecarbonyl]piperazino]-6-keto-hexyl]-trimethyl-ammonium; 2,2,2-trifluoroacetic acid Formula: C39H51Cl2F3N5O7S+ MolecularWeight: 861.81775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)NC4(CCCC4)C(=O)N5CCN(CC5)C(=O)CCCCC[N+](C)(C)C)Cl)C.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3Cl)S(=O)(=O)NC4(CCCC4)C(=O)N5CCN(CC5)C(=O)CCCCC[N+](C)(C)C)Cl)C.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C37H50Cl2N5O5S.C2HF3O2/c1-26-24-27(2)40-35-28(26)12-11-13-31(35)49-25-29-30(38)15-16-32(34(29)39)50(47,48)41-37(17-8-9-18-37)36(46)43-21-19-42(20-22-43)33(45)14-7-6-10-23-44(3,4)5;3-2(4,5)1(6)7/h11-13,15-16,24,41H,6-10,14,17-23,25H2,1-5H3;(H,6,7)/q+1;