6-chloranyl-8-[(E)-hydroxyiminomethyl]-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-chloranyl-8-[(E)-hydroxyiminomethyl]-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-chloro-8-[(E)-hydroxyiminomethyl]-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-chloro-8-[(E)-hydroxyiminomethyl]-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-chloro-8-[(E)-hydroxyiminomethyl]-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-chloro-8-[(E)-hydroximinomethyl]-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C12H9ClF3NO4 MolecularWeight: 323.65237

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=C1C=C(C=C2C=NO)Cl)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(OC2=C1C=C(C=C2/C=N/O)Cl)C(F)(F)F)C(=O)O

InChI

InChI=1S/C12H9ClF3NO4/c13-7-1-5-3-8(11(18)19)10(12(14,15)16)21-9(5)6(2-7)4-17-20/h1-2,4,8,10,20H,3H2,(H,18,19)/b17-4+