2-(3-bromanylphenoxy)ethyl 2-(4-chlorophenyl)quinoline-4-carboxylate

Systemtic Name: 2-(3-bromanylphenoxy)ethyl 2-(4-chlorophenyl)quinoline-4-carboxylate Openeye Name: 2-(3-bromophenoxy)ethyl 2-(4-chlorophenyl)quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-4-quinolinecarboxylic acid 2-(3-bromophenoxy)ethyl ester IUPAC Name: 2-(3-bromophenoxy)ethyl 2-(4-chlorophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)cinchoninic acid 2-(3-bromophenoxy)ethyl ester Formula: C24H17BrClNO3 MolecularWeight: 482.75368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)OCCOC4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)Cl)C(=O)OCCOC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H17BrClNO3/c25-17-4-3-5-19(14-17)29-12-13-30-24(28)21-15-23(16-8-10-18(26)11-9-16)27-22-7-2-1-6-20(21)22/h1-11,14-15H,12-13H2