(4-nitrophenyl)methyl 2-(2,5-dimethylphenyl)quinoline-4-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(2,5-dimethylphenyl)quinoline-4-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(2,5-dimethylphenyl)quinoline-4-carboxylate CAS Name: 2-(2,5-dimethylphenyl)-4-quinolinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(2,5-dimethylphenyl)quinoline-4-carboxylate Traditional Name: 2-(2,5-dimethylphenyl)cinchoninic acid (4-nitrobenzyl) ester Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H20N2O4/c1-16-7-8-17(2)21(13-16)24-14-22(20-5-3-4-6-23(20)26-24)25(28)31-15-18-9-11-19(12-10-18)27(29)30/h3-14H,15H2,1-2H3