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

Systemtic Name: 2-[3-[3-[2-(dimethylazaniumyl)ethoxy]phenyl]propanoylamino]ethanoate Openeye Name: 2-[3-[3-[2-(dimethylammonio)ethoxy]phenyl]propanoylamino]acetate CAS Name: 2-[[3-[3-[2-(dimethylammonio)ethoxy]phenyl]-1-oxopropyl]amino]acetate IUPAC Name: 2-[3-[3-[2-(dimethylazaniumyl)ethoxy]phenyl]propanoylamino]acetate Traditional Name: 2-[3-[3-[2-(dimethylammonio)ethoxy]phenyl]propanoylamino]acetate Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O4/c1-17(2)8-9-21-13-5-3-4-12(10-13)6-7-14(18)16-11-15(19)20/h3-5,10H,6-9,11H2,1-2H3,(H,16,18)(H,19,20)