ethyl 5-[(5-bromanylpyridin-3-yl)carbonylamino]-2-morpholin-4-yl-benzoate

Systemtic Name: ethyl 5-[(5-bromanylpyridin-3-yl)carbonylamino]-2-morpholin-4-yl-benzoate Openeye Name: ethyl 5-[(5-bromopyridine-3-carbonyl)amino]-2-morpholino-benzoate CAS Name: 5-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-2-(4-morpholinyl)benzoic acid ethyl ester IUPAC Name: ethyl 5-[(5-bromopyridine-3-carbonyl)amino]-2-morpholin-4-ylbenzoate Traditional Name: 5-[(5-bromonicotinoyl)amino]-2-morpholino-benzoic acid ethyl ester Formula: C19H20BrN3O4 MolecularWeight: 434.2838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=CN=C2)Br)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=CN=C2)Br)N3CCOCC3

InChI

InChI=1S/C19H20BrN3O4/c1-2-27-19(25)16-10-15(3-4-17(16)23-5-7-26-8-6-23)22-18(24)13-9-14(20)12-21-11-13/h3-4,9-12H,2,5-8H2,1H3,(H,22,24)