(2-morpholin-4-yl-2-oxidanylidene-ethyl) 3,5-bis(bromanyl)-2-oxidanyl-benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 3,5-bis(bromanyl)-2-oxidanyl-benzoate Openeye Name: (2-morpholino-2-oxo-ethyl) 3,5-dibromo-2-hydroxy-benzoate CAS Name: 3,5-dibromo-2-hydroxybenzoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 3,5-dibromo-2-hydroxybenzoate Traditional Name: 3,5-dibromo-2-hydroxy-benzoic acid (2-keto-2-morpholino-ethyl) ester Formula: C13H13Br2NO5 MolecularWeight: 423.05402

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)COC(=O)C2=CC(=CC(=C2O)Br)Br

Isomeric SMILES

C1COCCN1C(=O)COC(=O)C2=CC(=CC(=C2O)Br)Br

InChI

InChI=1S/C13H13Br2NO5/c14-8-5-9(12(18)10(15)6-8)13(19)21-7-11(17)16-1-3-20-4-2-16/h5-6,18H,1-4,7H2