(2-cyanophenyl)methyl 2-(4-methoxyphenyl)quinoline-4-carboxylate

Systemtic Name: (2-cyanophenyl)methyl 2-(4-methoxyphenyl)quinoline-4-carboxylate Openeye Name: (2-cyanophenyl)methyl 2-(4-methoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-4-quinolinecarboxylic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-(4-methoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)cinchoninic acid (2-cyanobenzyl) ester Formula: C25H18N2O3 MolecularWeight: 394.42202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=CC=C4C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=CC=C4C#N

InChI

InChI=1S/C25H18N2O3/c1-29-20-12-10-17(11-13-20)24-14-22(21-8-4-5-9-23(21)27-24)25(28)30-16-19-7-3-2-6-18(19)15-26/h2-14H,16H2,1H3