7-(diethylamino)-6-[2-(4-fluorophenyl)ethynyl]-2-oxidanylidene-chromene-3-carboxylic acid

Systemtic Name: 7-(diethylamino)-6-[2-(4-fluorophenyl)ethynyl]-2-oxidanylidene-chromene-3-carboxylic acid Openeye Name: 7-(diethylamino)-6-[2-(4-fluorophenyl)ethynyl]-2-oxo-chromene-3-carboxylic acid CAS Name: 7-(diethylamino)-6-[2-(4-fluorophenyl)ethynyl]-2-oxo-1-benzopyran-3-carboxylic acid IUPAC Name: 7-(diethylamino)-6-[2-(4-fluorophenyl)ethynyl]-2-oxochromene-3-carboxylic acid Traditional Name: 7-(diethylamino)-6-[2-(4-fluorophenyl)ethynyl]-2-keto-chromene-3-carboxylic acid Formula: C22H18FNO4 MolecularWeight: 379.381023

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1C#CC3=CC=C(C=C3)F)C=C(C(=O)O2)C(=O)O

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1C#CC3=CC=C(C=C3)F)C=C(C(=O)O2)C(=O)O

InChI

InChI=1S/C22H18FNO4/c1-3-24(4-2)19-13-20-16(12-18(21(25)26)22(27)28-20)11-15(19)8-5-14-6-9-17(23)10-7-14/h6-7,9-13H,3-4H2,1-2H3,(H,25,26)