3-bromanyl-5-methoxy-4-[2-(2-oxidanylideneimidazolidin-1-yl)ethoxy]benzoic acid

Systemtic Name: 3-bromanyl-5-methoxy-4-[2-(2-oxidanylideneimidazolidin-1-yl)ethoxy]benzoic acid Openeye Name: 3-bromo-5-methoxy-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]benzoic acid CAS Name: 3-bromo-5-methoxy-4-[2-(2-oxo-1-imidazolidinyl)ethoxy]benzoic acid IUPAC Name: 3-bromo-5-methoxy-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]benzoic acid Traditional Name: 3-bromo-4-[2-(2-ketoimidazolidin-1-yl)ethoxy]-5-methoxy-benzoic acid Formula: C13H15BrN2O5 MolecularWeight: 359.1726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)O)Br)OCCN2CCNC2=O

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)O)Br)OCCN2CCNC2=O

InChI

InChI=1S/C13H15BrN2O5/c1-20-10-7-8(12(17)18)6-9(14)11(10)21-5-4-16-3-2-15-13(16)19/h6-7H,2-5H2,1H3,(H,15,19)(H,17,18)