ethyl 2-but-3-ynyl-6,7-bis(fluoranyl)-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 2-but-3-ynyl-6,7-bis(fluoranyl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 2-but-3-ynyl-6,7-difluoro-4-oxo-1H-quinoline-3-carboxylate CAS Name: 2-but-3-ynyl-6,7-difluoro-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-but-3-ynyl-6,7-difluoro-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 2-but-3-ynyl-6,7-difluoro-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C16H13F2NO3 MolecularWeight: 305.276126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)F)CCC#C

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)F)CCC#C

InChI

InChI=1S/C16H13F2NO3/c1-3-5-6-12-14(16(21)22-4-2)15(20)9-7-10(17)11(18)8-13(9)19-12/h1,7-8H,4-6H2,2H3,(H,19,20)