2-[4-chloranyl-3-[(dimethylazaniumyl)methyl]phenoxy]ethanoate

Systemtic Name: 2-[4-chloranyl-3-[(dimethylazaniumyl)methyl]phenoxy]ethanoate Openeye Name: 2-[4-chloro-3-[(dimethylammonio)methyl]phenoxy]acetate CAS Name: 2-[4-chloro-3-[(dimethylammonio)methyl]phenoxy]acetate IUPAC Name: 2-[4-chloro-3-[(dimethylazaniumyl)methyl]phenoxy]acetate Traditional Name: 2-[4-chloro-3-[(dimethylammonio)methyl]phenoxy]acetate Formula: C11H14ClNO3 MolecularWeight: 243.68676

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC(=C1)OCC(=O)[O-])Cl

Isomeric SMILES

C[NH+](C)CC1=C(C=CC(=C1)OCC(=O)[O-])Cl

InChI

InChI=1S/C11H14ClNO3/c1-13(2)6-8-5-9(3-4-10(8)12)16-7-11(14)15/h3-5H,6-7H2,1-2H3,(H,14,15)