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

Systemtic Name: methyl 5-[[4-(3-bromanyl-2-methyl-phenyl)carbonylmorpholin-2-yl]methoxy]pyridine-3-carboxylate Openeye Name: methyl 5-[[4-(3-bromo-2-methyl-benzoyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate CAS Name: 5-[[4-[(3-bromo-2-methylphenyl)-oxomethyl]-2-morpholinyl]methoxy]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(3-bromo-2-methylbenzoyl)morpholin-2-yl]methoxy]pyridine-3-carboxylate Traditional Name: 5-[[4-(3-bromo-2-methyl-benzoyl)morpholin-2-yl]methoxy]nicotinic acid methyl ester Formula: C20H21BrN2O5 MolecularWeight: 449.29514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Br)C(=O)N2CCOC(C2)COC3=CN=CC(=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1Br)C(=O)N2CCOC(C2)COC3=CN=CC(=C3)C(=O)OC

InChI

InChI=1S/C20H21BrN2O5/c1-13-17(4-3-5-18(13)21)19(24)23-6-7-27-16(11-23)12-28-15-8-14(9-22-10-15)20(25)26-2/h3-5,8-10,16H,6-7,11-12H2,1-2H3