[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl] quinoline-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl] quinoline-2-carboxylate Openeye Name: [2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl] quinoline-2-carboxylate Traditional Name: quinaldic acid [2-keto-2-(3,4,5-trimethoxyphenyl)ethyl] ester Formula: C21H19NO6 MolecularWeight: 381.37866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)COC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)COC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H19NO6/c1-25-18-10-14(11-19(26-2)20(18)27-3)17(23)12-28-21(24)16-9-8-13-6-4-5-7-15(13)22-16/h4-11H,12H2,1-3H3