3-[4-[3-(dimethylazaniumyl)propoxy]phenyl]propanoate

Systemtic Name: 3-[4-[3-(dimethylazaniumyl)propoxy]phenyl]propanoate Openeye Name: 3-[4-[3-(dimethylammonio)propoxy]phenyl]propanoate CAS Name: 3-[4-[3-(dimethylammonio)propoxy]phenyl]propanoate IUPAC Name: 3-[4-[3-(dimethylazaniumyl)propoxy]phenyl]propanoate Traditional Name: 3-[4-[3-(dimethylammonio)propoxy]phenyl]propionate Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCOC1=CC=C(C=C1)CCC(=O)[O-]

Isomeric SMILES

C[NH+](C)CCCOC1=CC=C(C=C1)CCC(=O)[O-]

InChI

InChI=1S/C14H21NO3/c1-15(2)10-3-11-18-13-7-4-12(5-8-13)6-9-14(16)17/h4-5,7-8H,3,6,9-11H2,1-2H3,(H,16,17)