methyl 4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethoxy]-6-fluoranyl-quinoline-2-carboxylate

Systemtic Name: methyl 4-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethoxy]-6-fluoranyl-quinoline-2-carboxylate Openeye Name: methyl 4-[2-(3,4-dimethoxyphenyl)-2-oxo-ethoxy]-6-fluoro-quinoline-2-carboxylate CAS Name: 4-[2-(3,4-dimethoxyphenyl)-2-oxoethoxy]-6-fluoro-2-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(3,4-dimethoxyphenyl)-2-oxoethoxy]-6-fluoroquinoline-2-carboxylate Traditional Name: 4-[2-(3,4-dimethoxyphenyl)-2-keto-ethoxy]-6-fluoro-quinaldic acid methyl ester Formula: C21H18FNO6 MolecularWeight: 399.369123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC2=CC(=NC3=C2C=C(C=C3)F)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC2=CC(=NC3=C2C=C(C=C3)F)C(=O)OC)OC

InChI

InChI=1S/C21H18FNO6/c1-26-18-7-4-12(8-20(18)27-2)17(24)11-29-19-10-16(21(25)28-3)23-15-6-5-13(22)9-14(15)19/h4-10H,11H2,1-3H3