2-[3-[4-[2-(dimethylazaniumyl)ethoxy]phenyl]phenyl]ethanoate

Systemtic Name: 2-[3-[4-[2-(dimethylazaniumyl)ethoxy]phenyl]phenyl]ethanoate Openeye Name: 2-[3-[4-[2-(dimethylammonio)ethoxy]phenyl]phenyl]acetate CAS Name: 2-[3-[4-[2-(dimethylammonio)ethoxy]phenyl]phenyl]acetate IUPAC Name: 2-[3-[4-[2-(dimethylazaniumyl)ethoxy]phenyl]phenyl]acetate Traditional Name: 2-[3-[4-[2-(dimethylammonio)ethoxy]phenyl]phenyl]acetate Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC1=CC=C(C=C1)C2=CC(=CC=C2)CC(=O)[O-]

Isomeric SMILES

C[NH+](C)CCOC1=CC=C(C=C1)C2=CC(=CC=C2)CC(=O)[O-]

InChI

InChI=1S/C18H21NO3/c1-19(2)10-11-22-17-8-6-15(7-9-17)16-5-3-4-14(12-16)13-18(20)21/h3-9,12H,10-11,13H2,1-2H3,(H,20,21)