3-bromanyl-5-chloranyl-2-[2-(diethylazaniumyl)ethoxy]benzoate

Systemtic Name: 3-bromanyl-5-chloranyl-2-[2-(diethylazaniumyl)ethoxy]benzoate Openeye Name: 3-bromo-5-chloro-2-[2-(diethylammonio)ethoxy]benzoate CAS Name: 3-bromo-5-chloro-2-[2-(diethylammonio)ethoxy]benzoate IUPAC Name: 3-bromo-5-chloro-2-[2-(diethylazaniumyl)ethoxy]benzoate Traditional Name: 3-bromo-5-chloro-2-[2-(diethylammonio)ethoxy]benzoate Formula: C13H17BrClNO3 MolecularWeight: 350.63598

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=C(C=C(C=C1C(=O)[O-])Cl)Br

Isomeric SMILES

CC[NH+](CC)CCOC1=C(C=C(C=C1C(=O)[O-])Cl)Br

InChI

InChI=1S/C13H17BrClNO3/c1-3-16(4-2)5-6-19-12-10(13(17)18)7-9(15)8-11(12)14/h7-8H,3-6H2,1-2H3,(H,17,18)