(2-chloranyl-6-fluoranyl-phenyl)methyl 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 2-(5-chloro-2-thienyl)quinoline-4-carboxylate CAS Name: 2-(5-chloro-2-thiophenyl)-4-quinolinecarboxylic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 2-(5-chlorothiophen-2-yl)quinoline-4-carboxylate Traditional Name: 2-(5-chloro-2-thienyl)cinchoninic acid (2-chloro-6-fluoro-benzyl) ester Formula: C21H12Cl2FNO2S MolecularWeight: 432.294883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)OCC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)OCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H12Cl2FNO2S/c22-15-5-3-6-16(24)14(15)11-27-21(26)13-10-18(19-8-9-20(23)28-19)25-17-7-2-1-4-12(13)17/h1-10H,11H2