methyl 6-[2-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl]-2-methoxy-pyridine-3-carboxylate

Systemtic Name: methyl 6-[2-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl]-2-methoxy-pyridine-3-carboxylate Openeye Name: methyl 6-[2-(2-benzyloxy-5-bromo-phenyl)ethyl]-2-methoxy-pyridine-3-carboxylate CAS Name: 6-[2-(5-bromo-2-phenylmethoxyphenyl)ethyl]-2-methoxy-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-(5-bromo-2-phenylmethoxyphenyl)ethyl]-2-methoxypyridine-3-carboxylate Traditional Name: 6-[2-(2-benzoxy-5-bromo-phenyl)ethyl]-2-methoxy-nicotinic acid methyl ester Formula: C23H22BrNO4 MolecularWeight: 456.32908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=N1)CCC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=N1)CCC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H22BrNO4/c1-27-22-20(23(26)28-2)12-11-19(25-22)10-8-17-14-18(24)9-13-21(17)29-15-16-6-4-3-5-7-16/h3-7,9,11-14H,8,10,15H2,1-2H3