(2-chloranyl-6-fluoranyl-phenyl)methyl 2-methylquinoline-4-carboxylate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 2-methylquinoline-4-carboxylate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid (2-chloro-6-fluoro-benzyl) ester Formula: C18H13ClFNO2 MolecularWeight: 329.752723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H13ClFNO2/c1-11-9-13(12-5-2-3-8-17(12)21-11)18(22)23-10-14-15(19)6-4-7-16(14)20/h2-9H,10H2,1H3