methyl 5-bromanyl-3-[(4-fluorophenyl)methyl]-8-phenylmethoxy-quinoline-7-carboxylate

Systemtic Name: methyl 5-bromanyl-3-[(4-fluorophenyl)methyl]-8-phenylmethoxy-quinoline-7-carboxylate Openeye Name: methyl 8-benzyloxy-5-bromo-3-[(4-fluorophenyl)methyl]quinoline-7-carboxylate CAS Name: 5-bromo-3-[(4-fluorophenyl)methyl]-8-phenylmethoxy-7-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-[(4-fluorophenyl)methyl]-8-phenylmethoxyquinoline-7-carboxylate Traditional Name: 8-benzoxy-5-bromo-3-(4-fluorobenzyl)quinoline-7-carboxylic acid methyl ester Formula: C25H19BrFNO3 MolecularWeight: 480.325663

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=NC=C(C=C2C(=C1)Br)CC3=CC=C(C=C3)F)OCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=NC=C(C=C2C(=C1)Br)CC3=CC=C(C=C3)F)OCC4=CC=CC=C4

InChI

InChI=1S/C25H19BrFNO3/c1-30-25(29)21-13-22(26)20-12-18(11-16-7-9-19(27)10-8-16)14-28-23(20)24(21)31-15-17-5-3-2-4-6-17/h2-10,12-14H,11,15H2,1H3