6-chloranyl-7-(4-chloranyl-1-oxidanidyl-pyridin-1-ium-2-yl)oxy-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

Systemtic Name: 6-chloranyl-7-(4-chloranyl-1-oxidanidyl-pyridin-1-ium-2-yl)oxy-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Openeye Name: 6-chloro-7-(4-chloro-1-oxido-pyridin-1-ium-2-yl)oxy-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid CAS Name: 6-chloro-7-[(4-chloro-1-oxido-2-pyridin-1-iumyl)oxy]-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-chloro-7-(4-chloro-1-oxidopyridin-1-ium-2-yl)oxy-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Traditional Name: 6-chloro-7-(4-chloro-1-oxido-pyridin-1-ium-2-yl)oxy-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid Formula: C16H8Cl2F3NO5 MolecularWeight: 422.13963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=C(C=C1Cl)OC2=C(C=C3C=C(C(OC3=C2)C(F)(F)F)C(=O)O)Cl)[O-]

Isomeric SMILES

C1=C[N+](=C(C=C1Cl)OC2=C(C=C3C=C(C(OC3=C2)C(F)(F)F)C(=O)O)Cl)[O-]

InChI

InChI=1S/C16H8Cl2F3NO5/c17-8-1-2-22(25)13(5-8)26-12-6-11-7(4-10(12)18)3-9(15(23)24)14(27-11)16(19,20)21/h1-6,14H,(H,23,24)