(2-butoxy-2-oxidanylidene-ethyl) 2-(5-methylfuran-2-yl)quinoline-4-carboxylate

Systemtic Name: (2-butoxy-2-oxidanylidene-ethyl) 2-(5-methylfuran-2-yl)quinoline-4-carboxylate Openeye Name: (2-butoxy-2-oxo-ethyl) 2-(5-methyl-2-furyl)quinoline-4-carboxylate CAS Name: 2-(5-methyl-2-furanyl)-4-quinolinecarboxylic acid (2-butoxy-2-oxoethyl) ester IUPAC Name: (2-butoxy-2-oxoethyl) 2-(5-methylfuran-2-yl)quinoline-4-carboxylate Traditional Name: 2-(5-methyl-2-furyl)cinchoninic acid (2-butoxy-2-keto-ethyl) ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(O3)C

Isomeric SMILES

CCCCOC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(O3)C

InChI

InChI=1S/C21H21NO5/c1-3-4-11-25-20(23)13-26-21(24)16-12-18(19-10-9-14(2)27-19)22-17-8-6-5-7-15(16)17/h5-10,12H,3-4,11,13H2,1-2H3