(2-chloranyl-6-fluoranyl-phenyl)methyl 2-naphthalen-1-ylquinoline-4-carboxylate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 2-naphthalen-1-ylquinoline-4-carboxylate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 2-(1-naphthyl)quinoline-4-carboxylate CAS Name: 2-(1-naphthalenyl)-4-quinolinecarboxylic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 2-naphthalen-1-ylquinoline-4-carboxylate Traditional Name: 2-(1-naphthyl)cinchoninic acid (2-chloro-6-fluoro-benzyl) ester Formula: C27H17ClFNO2 MolecularWeight: 441.880783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NC4=CC=CC=C4C(=C3)C(=O)OCC5=C(C=CC=C5Cl)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NC4=CC=CC=C4C(=C3)C(=O)OCC5=C(C=CC=C5Cl)F

InChI

InChI=1S/C27H17ClFNO2/c28-23-12-6-13-24(29)22(23)16-32-27(31)21-15-26(30-25-14-4-3-10-20(21)25)19-11-5-8-17-7-1-2-9-18(17)19/h1-15H,16H2