[(1S)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 2-(2-chlorophenyl)quinoline-4-carboxylate

Systemtic Name: [(1S)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl] 2-(2-chlorophenyl)quinoline-4-carboxylate Openeye Name: [(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 2-(2-chlorophenyl)quinoline-4-carboxylate CAS Name: 2-(2-chlorophenyl)-4-quinolinecarboxylic acid [(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] ester IUPAC Name: [(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl] 2-(2-chlorophenyl)quinoline-4-carboxylate Traditional Name: 2-(2-chlorophenyl)cinchoninic acid [(1S)-1-(4-keto-1H-quinazolin-2-yl)ethyl] ester Formula: C26H18ClN3O3 MolecularWeight: 455.89242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

Isomeric SMILES

C[C@@H](C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

InChI

InChI=1S/C26H18ClN3O3/c1-15(24-29-22-13-7-4-10-18(22)25(31)30-24)33-26(32)19-14-23(17-9-2-5-11-20(17)27)28-21-12-6-3-8-16(19)21/h2-15H,1H3,(H,29,30,31)/t15-/m0/s1