6-azanyl-5-cyano-2-ethyl-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylic acid

Systemtic Name: 6-azanyl-5-cyano-2-ethyl-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylic acid Openeye Name: 6-amino-5-cyano-2-ethyl-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylic acid CAS Name: 6-amino-5-cyano-2-ethyl-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylic acid IUPAC Name: 6-amino-5-cyano-2-ethyl-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylic acid Traditional Name: 6-amino-5-cyano-2-ethyl-4-[2-(trifluoromethyl)phenyl]-4H-pyran-3-carboxylic acid Formula: C16H13F3N2O3 MolecularWeight: 338.28123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=C(O1)N)C#N)C2=CC=CC=C2C(F)(F)F)C(=O)O

Isomeric SMILES

CCC1=C(C(C(=C(O1)N)C#N)C2=CC=CC=C2C(F)(F)F)C(=O)O

InChI

InChI=1S/C16H13F3N2O3/c1-2-11-13(15(22)23)12(9(7-20)14(21)24-11)8-5-3-4-6-10(8)16(17,18)19/h3-6,12H,2,21H2,1H3,(H,22,23)