ethyl 1-ethyl-6,8-bis(fluoranyl)-7-(4-methoxyphenyl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 1-ethyl-6,8-bis(fluoranyl)-7-(4-methoxyphenyl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 1-ethyl-6,8-difluoro-7-(4-methoxyphenyl)-4-oxo-quinoline-3-carboxylate CAS Name: 1-ethyl-6,8-difluoro-7-(4-methoxyphenyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-6,8-difluoro-7-(4-methoxyphenyl)-4-oxoquinoline-3-carboxylate Traditional Name: 1-ethyl-6,8-difluoro-4-keto-7-(4-methoxyphenyl)quinoline-3-carboxylic acid ethyl ester Formula: C21H19F2NO4 MolecularWeight: 387.376666

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)C3=CC=C(C=C3)OC)F)C(=O)OCC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)C3=CC=C(C=C3)OC)F)C(=O)OCC

InChI

InChI=1S/C21H19F2NO4/c1-4-24-11-15(21(26)28-5-2)20(25)14-10-16(22)17(18(23)19(14)24)12-6-8-13(27-3)9-7-12/h6-11H,4-5H2,1-3H3