(4-cyanophenyl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: (4-cyanophenyl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3-methyl-2-phenyl-4-quinolinecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 3-methyl-2-phenyl-cinchoninic acid (4-cyanobenzyl) ester Formula: C25H18N2O2 MolecularWeight: 378.42262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H18N2O2/c1-17-23(25(28)29-16-19-13-11-18(15-26)12-14-19)21-9-5-6-10-22(21)27-24(17)20-7-3-2-4-8-20/h2-14H,16H2,1H3