(3,4-dichlorophenyl)methyl 2-pyridin-3-ylquinoline-4-carboxylate

Systemtic Name: (3,4-dichlorophenyl)methyl 2-pyridin-3-ylquinoline-4-carboxylate Openeye Name: (3,4-dichlorophenyl)methyl 2-(3-pyridyl)quinoline-4-carboxylate CAS Name: 2-(3-pyridinyl)-4-quinolinecarboxylic acid (3,4-dichlorophenyl)methyl ester IUPAC Name: (3,4-dichlorophenyl)methyl 2-pyridin-3-ylquinoline-4-carboxylate Traditional Name: 2-(3-pyridyl)cinchoninic acid (3,4-dichlorobenzyl) ester Formula: C22H14Cl2N2O2 MolecularWeight: 409.26476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)OCC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)OCC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H14Cl2N2O2/c23-18-8-7-14(10-19(18)24)13-28-22(27)17-11-21(15-4-3-9-25-12-15)26-20-6-2-1-5-16(17)20/h1-12H,13H2