(4-ethyl-3-fluoranyl-phenyl) 8-ethynyl-2,2,4,4-tetramethyl-3H-chromene-6-carboxylate

Systemtic Name: (4-ethyl-3-fluoranyl-phenyl) 8-ethynyl-2,2,4,4-tetramethyl-3H-chromene-6-carboxylate Openeye Name: (4-ethyl-3-fluoro-phenyl) 8-ethynyl-2,2,4,4-tetramethyl-chromane-6-carboxylate CAS Name: 8-ethynyl-2,2,4,4-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid (4-ethyl-3-fluorophenyl) ester IUPAC Name: (4-ethyl-3-fluorophenyl) 8-ethynyl-2,2,4,4-tetramethyl-3H-chromene-6-carboxylate Traditional Name: 8-ethynyl-2,2,4,4-tetramethyl-chroman-6-carboxylic acid (4-ethyl-3-fluoro-phenyl) ester Formula: C24H25FO3 MolecularWeight: 380.451903

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)OC(=O)C2=CC3=C(C(=C2)C#C)OC(CC3(C)C)(C)C)F

Isomeric SMILES

CCC1=C(C=C(C=C1)OC(=O)C2=CC3=C(C(=C2)C#C)OC(CC3(C)C)(C)C)F

InChI

InChI=1S/C24H25FO3/c1-7-15-9-10-18(13-20(15)25)27-22(26)17-11-16(8-2)21-19(12-17)23(3,4)14-24(5,6)28-21/h2,9-13H,7,14H2,1,3-6H3