3-chloranyl-4-[2-(diethylazaniumyl)ethoxy]-5-ethoxy-benzoate

Systemtic Name: 3-chloranyl-4-[2-(diethylazaniumyl)ethoxy]-5-ethoxy-benzoate Openeye Name: 3-chloro-4-[2-(diethylammonio)ethoxy]-5-ethoxy-benzoate CAS Name: 3-chloro-4-[2-(diethylammonio)ethoxy]-5-ethoxybenzoate IUPAC Name: 3-chloro-4-[2-(diethylazaniumyl)ethoxy]-5-ethoxybenzoate Traditional Name: 3-chloro-4-[2-(diethylammonio)ethoxy]-5-ethoxy-benzoate Formula: C15H22ClNO4 MolecularWeight: 315.79248

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=C(C=C(C=C1Cl)C(=O)[O-])OCC

Isomeric SMILES

CC[NH+](CC)CCOC1=C(C=C(C=C1Cl)C(=O)[O-])OCC

InChI

InChI=1S/C15H22ClNO4/c1-4-17(5-2)7-8-21-14-12(16)9-11(15(18)19)10-13(14)20-6-3/h9-10H,4-8H2,1-3H3,(H,18,19)