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

Systemtic Name: methyl 1-ethyl-6-fluoranyl-4-oxidanylidene-7,8-bis(phenylmethoxy)quinoline-3-carboxylate Openeye Name: methyl 7,8-dibenzyloxy-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylate CAS Name: 1-ethyl-6-fluoro-4-oxo-7,8-bis(phenylmethoxy)-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-6-fluoro-4-oxo-7,8-bis(phenylmethoxy)quinoline-3-carboxylate Traditional Name: 7,8-dibenzoxy-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid methyl ester Formula: C27H24FNO5 MolecularWeight: 461.481563

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)OCC3=CC=CC=C3)OCC4=CC=CC=C4)F)C(=O)OC

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)OCC3=CC=CC=C3)OCC4=CC=CC=C4)F)C(=O)OC

InChI

InChI=1S/C27H24FNO5/c1-3-29-15-21(27(31)32-2)24(30)20-14-22(28)25(33-16-18-10-6-4-7-11-18)26(23(20)29)34-17-19-12-8-5-9-13-19/h4-15H,3,16-17H2,1-2H3