3-bromanyl-5-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoic acid

Systemtic Name: 3-bromanyl-5-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)benzoic acid Openeye Name: 3-bromo-5-methoxy-4-(2-morpholino-2-oxo-ethoxy)benzoic acid CAS Name: 3-bromo-5-methoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]benzoic acid IUPAC Name: 3-bromo-5-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)benzoic acid Traditional Name: 3-bromo-4-(2-keto-2-morpholino-ethoxy)-5-methoxy-benzoic acid Formula: C14H16BrNO6 MolecularWeight: 374.18394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)Br)OCC(=O)N2CCOCC2

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)Br)OCC(=O)N2CCOCC2

InChI

InChI=1S/C14H16BrNO6/c1-20-11-7-9(14(18)19)6-10(15)13(11)22-8-12(17)16-2-4-21-5-3-16/h6-7H,2-5,8H2,1H3,(H,18,19)