(2-bromanyl-4-fluoranyl-phenyl)methyl 2-(methoxymethyl)-4-methyl-quinoline-3-carboxylate

Systemtic Name: (2-bromanyl-4-fluoranyl-phenyl)methyl 2-(methoxymethyl)-4-methyl-quinoline-3-carboxylate Openeye Name: (2-bromo-4-fluoro-phenyl)methyl 2-(methoxymethyl)-4-methyl-quinoline-3-carboxylate CAS Name: 2-(methoxymethyl)-4-methyl-3-quinolinecarboxylic acid (2-bromo-4-fluorophenyl)methyl ester IUPAC Name: (2-bromo-4-fluorophenyl)methyl 2-(methoxymethyl)-4-methylquinoline-3-carboxylate Traditional Name: 2-(methoxymethyl)-4-methyl-quinoline-3-carboxylic acid (2-bromo-4-fluoro-benzyl) ester Formula: C20H17BrFNO3 MolecularWeight: 418.256283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC)C(=O)OCC3=C(C=C(C=C3)F)Br

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC)C(=O)OCC3=C(C=C(C=C3)F)Br

InChI

InChI=1S/C20H17BrFNO3/c1-12-15-5-3-4-6-17(15)23-18(11-25-2)19(12)20(24)26-10-13-7-8-14(22)9-16(13)21/h3-9H,10-11H2,1-2H3