3-bromanyl-5-chloranyl-2-(2-morpholin-4-ium-4-ylethoxy)benzoate

Systemtic Name: 3-bromanyl-5-chloranyl-2-(2-morpholin-4-ium-4-ylethoxy)benzoate Openeye Name: 3-bromo-5-chloro-2-(2-morpholin-4-ium-4-ylethoxy)benzoate CAS Name: 3-bromo-5-chloro-2-[2-(4-morpholin-4-iumyl)ethoxy]benzoate IUPAC Name: 3-bromo-5-chloro-2-(2-morpholin-4-ium-4-ylethoxy)benzoate Traditional Name: 3-bromo-5-chloro-2-(2-morpholin-4-ium-4-ylethoxy)benzoate Formula: C13H15BrClNO4 MolecularWeight: 364.6195

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCOC2=C(C=C(C=C2C(=O)[O-])Cl)Br

Isomeric SMILES

C1COCC[NH+]1CCOC2=C(C=C(C=C2C(=O)[O-])Cl)Br

InChI

InChI=1S/C13H15BrClNO4/c14-11-8-9(15)7-10(13(17)18)12(11)20-6-3-16-1-4-19-5-2-16/h7-8H,1-6H2,(H,17,18)