6-cyano-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid

Systemtic Name: 6-cyano-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Openeye Name: 6-cyano-2-(trifluoromethyl)chromane-3-carboxylic acid CAS Name: 6-cyano-2-(trifluoromethyl)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid IUPAC Name: 6-cyano-2-(trifluoromethyl)-3,4-dihydro-2H-chromene-3-carboxylic acid Traditional Name: 6-cyano-2-(trifluoromethyl)chroman-3-carboxylic acid Formula: C12H8F3NO3 MolecularWeight: 271.19203

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC2=C1C=C(C=C2)C#N)C(F)(F)F)C(=O)O

Isomeric SMILES

C1C(C(OC2=C1C=C(C=C2)C#N)C(F)(F)F)C(=O)O

InChI

InChI=1S/C12H8F3NO3/c13-12(14,15)10-8(11(17)18)4-7-3-6(5-16)1-2-9(7)19-10/h1-3,8,10H,4H2,(H,17,18)