(4-nitrophenyl)methyl 2-(4-propan-2-ylphenyl)quinoline-4-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-(4-propan-2-ylphenyl)quinoline-4-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-(4-isopropylphenyl)quinoline-4-carboxylate CAS Name: 2-(4-propan-2-ylphenyl)-4-quinolinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(4-propan-2-ylphenyl)quinoline-4-carboxylate Traditional Name: 2-p-cumenylcinchoninic acid (4-nitrobenzyl) ester Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22N2O4/c1-17(2)19-9-11-20(12-10-19)25-15-23(22-5-3-4-6-24(22)27-25)26(29)32-16-18-7-13-21(14-8-18)28(30)31/h3-15,17H,16H2,1-2H3