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

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

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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=CC=NC=C5

Isomeric SMILES

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

InChI

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