ethyl 2-[(2-chloranyl-6-fluoranyl-phenyl)carbonyloxymethyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 2-[(2-chloranyl-6-fluoranyl-phenyl)carbonyloxymethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: ethyl 2-[(2-chloro-6-fluoro-benzoyl)oxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[(2-chloro-6-fluorophenyl)-oxomethoxy]methyl]-4-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloro-6-fluorobenzoyl)oxymethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[(2-chloro-6-fluoro-benzoyl)oxymethyl]-4-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C21H17ClFNO4 MolecularWeight: 401.815383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=C(C=CC=C3Cl)F)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)C3=C(C=CC=C3Cl)F)C

InChI

InChI=1S/C21H17ClFNO4/c1-3-27-20(25)18-12(2)13-7-4-5-10-16(13)24-17(18)11-28-21(26)19-14(22)8-6-9-15(19)23/h4-10H,3,11H2,1-2H3