[(2R)-2-[[4-ethoxy-3-(morpholin-4-ylcarbonylamino)phenyl]sulfonylamino]-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: [(2R)-2-[[4-ethoxy-3-(morpholin-4-ylcarbonylamino)phenyl]sulfonylamino]-4-oxidanyl-4-oxidanylidene-butyl]-trimethyl-azanium; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: [(2R)-2-[[4-ethoxy-3-(morpholine-4-carbonylamino)phenyl]sulfonylamino]-4-hydroxy-4-oxo-butyl]-trimethyl-ammonium; 2,2,2-trifluoroacetic acid CAS Name: [(2R)-2-[[4-ethoxy-3-[[4-morpholinyl(oxo)methyl]amino]phenyl]sulfonylamino]-4-hydroxy-4-oxobutyl]-trimethylammonium; 2,2,2-trifluoroacetic acid IUPAC Name: [(2R)-2-[[4-ethoxy-3-(morpholine-4-carbonylamino)phenyl]sulfonylamino]-4-hydroxy-4-oxobutyl]-trimethylazanium; 2,2,2-trifluoroacetic acid Traditional Name: [(2R)-2-[[4-ethoxy-3-(morpholine-4-carbonylamino)phenyl]sulfonylamino]-4-hydroxy-4-keto-butyl]-trimethyl-ammonium; 2,2,2-trifluoroacetic acid Formula: C22H34F3N4O9S+ MolecularWeight: 587.58697

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NC(CC(=O)O)C[N+](C)(C)C)NC(=O)N2CCOCC2.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N[C@H](CC(=O)O)C[N+](C)(C)C)NC(=O)N2CCOCC2.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C20H32N4O7S.C2HF3O2/c1-5-31-18-7-6-16(13-17(18)21-20(27)23-8-10-30-11-9-23)32(28,29)22-15(12-19(25)26)14-24(2,3)4;3-2(4,5)1(6)7/h6-7,13,15,22H,5,8-12,14H2,1-4H3,(H-,21,25,26,27);(H,6,7)/p+1/t15-;/m1./s1