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

Systemtic Name: 5-chloranyl-2-[2-(diethylazaniumyl)ethoxy]benzoate Openeye Name: 5-chloro-2-[2-(diethylammonio)ethoxy]benzoate CAS Name: 5-chloro-2-[2-(diethylammonio)ethoxy]benzoate IUPAC Name: 5-chloro-2-[2-(diethylazaniumyl)ethoxy]benzoate Traditional Name: 5-chloro-2-[2-(diethylammonio)ethoxy]benzoate Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=C(C=C(C=C1)Cl)C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCOC1=C(C=C(C=C1)Cl)C(=O)[O-]

InChI

InChI=1S/C13H18ClNO3/c1-3-15(4-2)7-8-18-12-6-5-10(14)9-11(12)13(16)17/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,17)