(phenylmethyl) 2-(2,5-dimethylphenyl)quinoline-4-carboxylate

Systemtic Name: (phenylmethyl) 2-(2,5-dimethylphenyl)quinoline-4-carboxylate Openeye Name: benzyl 2-(2,5-dimethylphenyl)quinoline-4-carboxylate CAS Name: 2-(2,5-dimethylphenyl)-4-quinolinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2,5-dimethylphenyl)quinoline-4-carboxylate Traditional Name: 2-(2,5-dimethylphenyl)cinchoninic acid benzyl ester Formula: C25H21NO2 MolecularWeight: 367.43974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C25H21NO2/c1-17-12-13-18(2)21(14-17)24-15-22(20-10-6-7-11-23(20)26-24)25(27)28-16-19-8-4-3-5-9-19/h3-15H,16H2,1-2H3