3-[3-[2-(dimethylazaniumyl)ethoxy]-4-methoxy-phenyl]propanoate

Systemtic Name: 3-[3-[2-(dimethylazaniumyl)ethoxy]-4-methoxy-phenyl]propanoate Openeye Name: 3-[3-[2-(dimethylammonio)ethoxy]-4-methoxy-phenyl]propanoate CAS Name: 3-[3-[2-(dimethylammonio)ethoxy]-4-methoxyphenyl]propanoate IUPAC Name: 3-[3-[2-(dimethylazaniumyl)ethoxy]-4-methoxyphenyl]propanoate Traditional Name: 3-[3-[2-(dimethylammonio)ethoxy]-4-methoxy-phenyl]propionate Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO4/c1-15(2)8-9-19-13-10-11(5-7-14(16)17)4-6-12(13)18-3/h4,6,10H,5,7-9H2,1-3H3,(H,16,17)