(2-butoxy-2-oxidanylidene-ethyl) 2-(4-methoxyphenyl)quinoline-4-carboxylate

Systemtic Name: (2-butoxy-2-oxidanylidene-ethyl) 2-(4-methoxyphenyl)quinoline-4-carboxylate Openeye Name: (2-butoxy-2-oxo-ethyl) 2-(4-methoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-4-quinolinecarboxylic acid (2-butoxy-2-oxoethyl) ester IUPAC Name: (2-butoxy-2-oxoethyl) 2-(4-methoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)cinchoninic acid (2-butoxy-2-keto-ethyl) ester Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23NO5/c1-3-4-13-28-22(25)15-29-23(26)19-14-21(16-9-11-17(27-2)12-10-16)24-20-8-6-5-7-18(19)20/h5-12,14H,3-4,13,15H2,1-2H3