(E)-[3-[2,4-bis(chloranyl)phenoxy]-4-oxidanyl-4-oxidanylidene-butylidene]-[5-cyano-4-(trifluoromethyl)-1,3-thiazol-2-yl]-methoxy-azanium

Systemtic Name: (E)-[3-[2,4-bis(chloranyl)phenoxy]-4-oxidanyl-4-oxidanylidene-butylidene]-[5-cyano-4-(trifluoromethyl)-1,3-thiazol-2-yl]-methoxy-azanium Openeye Name: (E)-[5-cyano-4-(trifluoromethyl)thiazol-2-yl]-[3-(2,4-dichlorophenoxy)-4-hydroxy-4-oxo-butylidene]-methoxy-ammonium CAS Name: (E)-[5-cyano-4-(trifluoromethyl)-2-thiazolyl]-[3-(2,4-dichlorophenoxy)-4-hydroxy-4-oxobutylidene]-methoxyammonium IUPAC Name: (E)-[5-cyano-4-(trifluoromethyl)-1,3-thiazol-2-yl]-[3-(2,4-dichlorophenoxy)-4-hydroxy-4-oxobutylidene]-methoxyazanium Traditional Name: (E)-[5-cyano-4-(trifluoromethyl)thiazol-2-yl]-[3-(2,4-dichlorophenoxy)-4-hydroxy-4-keto-butylidene]-methoxy-ammonium Formula: C16H11Cl2F3N3O4S+ MolecularWeight: 469.24245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CO[N+](=CCC(C(=O)O)OC1=C(C=C(C=C1)Cl)Cl)C2=NC(=C(S2)C#N)C(F)(F)F

Isomeric SMILES

CO/[N+](=C/CC(C(=O)O)OC1=C(C=C(C=C1)Cl)Cl)/C2=NC(=C(S2)C#N)C(F)(F)F

InChI

InChI=1S/C16H10Cl2F3N3O4S/c1-27-24(15-23-13(16(19,20)21)12(7-22)29-15)5-4-11(14(25)26)28-10-3-2-8(17)6-9(10)18/h2-3,5-6,11H,4H2,1H3/p+1/b24-5+