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

Systemtic Name: methyl 5-[[4-(5-bromanylthiophen-2-yl)carbonylmorpholin-2-yl]methoxy]pyridine-3-carboxylate Openeye Name: methyl 5-[[4-(5-bromothiophene-2-carbonyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate CAS Name: 5-[[4-[(5-bromo-2-thiophenyl)-oxomethyl]-2-morpholinyl]methoxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(5-bromothiophene-2-carbonyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate Traditional Name: 5-[[4-(5-bromothiophene-2-carbonyl)morpholin-2-yl]methoxy]nicotinic acid methyl ester Formula: C17H17BrN2O5S MolecularWeight: 441.29628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CN=C1)OCC2CN(CCO2)C(=O)C3=CC=C(S3)Br

Isomeric SMILES

COC(=O)C1=CC(=CN=C1)OCC2CN(CCO2)C(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H17BrN2O5S/c1-23-17(22)11-6-12(8-19-7-11)25-10-13-9-20(4-5-24-13)16(21)14-2-3-15(18)26-14/h2-3,6-8,13H,4-5,9-10H2,1H3