(4-nitrophenyl)methyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(3,4-dimethoxyphenyl)-4-quinolinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(3,4-dimethoxyphenyl)cinchoninic acid (4-nitrobenzyl) ester Formula: C25H20N2O6 MolecularWeight: 444.4361

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C25H20N2O6/c1-31-23-12-9-17(13-24(23)32-2)22-14-20(19-5-3-4-6-21(19)26-22)25(28)33-15-16-7-10-18(11-8-16)27(29)30/h3-14H,15H2,1-2H3