(2-oxidanylidene-1,2-diphenyl-ethyl) 2-pyridin-3-ylquinoline-4-carboxylate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 2-pyridin-3-ylquinoline-4-carboxylate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 2-(3-pyridyl)quinoline-4-carboxylate CAS Name: 2-(3-pyridinyl)-4-quinolinecarboxylic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 2-pyridin-3-ylquinoline-4-carboxylate Traditional Name: 2-(3-pyridyl)cinchoninic acid desyl ester Formula: C29H20N2O3 MolecularWeight: 444.4807

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C29H20N2O3/c32-27(20-10-3-1-4-11-20)28(21-12-5-2-6-13-21)34-29(33)24-18-26(22-14-9-17-30-19-22)31-25-16-8-7-15-23(24)25/h1-19,28H