2-phenoxyethyl 2-(4-bromophenyl)quinoline-4-carboxylate

Systemtic Name: 2-phenoxyethyl 2-(4-bromophenyl)quinoline-4-carboxylate Openeye Name: 2-phenoxyethyl 2-(4-bromophenyl)quinoline-4-carboxylate CAS Name: 2-(4-bromophenyl)-4-quinolinecarboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 2-(4-bromophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-bromophenyl)cinchoninic acid 2-phenoxyethyl ester Formula: C24H18BrNO3 MolecularWeight: 448.30862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)OCCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H18BrNO3/c25-18-12-10-17(11-13-18)23-16-21(20-8-4-5-9-22(20)26-23)24(27)29-15-14-28-19-6-2-1-3-7-19/h1-13,16H,14-15H2