methyl 5-[[4-(2-bromanyl-5-methoxy-phenyl)carbonylmorpholin-2-yl]methoxy]pyridine-3-carboxylate

Systemtic Name: methyl 5-[[4-(2-bromanyl-5-methoxy-phenyl)carbonylmorpholin-2-yl]methoxy]pyridine-3-carboxylate Openeye Name: methyl 5-[[4-(2-bromo-5-methoxy-benzoyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate CAS Name: 5-[[4-[(2-bromo-5-methoxyphenyl)-oxomethyl]-2-morpholinyl]methoxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(2-bromo-5-methoxybenzoyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate Traditional Name: 5-[[4-(2-bromo-5-methoxy-benzoyl)morpholin-2-yl]methoxy]nicotinic acid methyl ester Formula: C20H21BrN2O6 MolecularWeight: 465.29454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)N2CCOC(C2)COC3=CN=CC(=C3)C(=O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)N2CCOC(C2)COC3=CN=CC(=C3)C(=O)OC

InChI

InChI=1S/C20H21BrN2O6/c1-26-14-3-4-18(21)17(8-14)19(24)23-5-6-28-16(11-23)12-29-15-7-13(9-22-10-15)20(25)27-2/h3-4,7-10,16H,5-6,11-12H2,1-2H3