3-[4-[2-(diethylazaniumyl)ethoxy]-3-ethoxy-phenyl]propanoate

Systemtic Name: 3-[4-[2-(diethylazaniumyl)ethoxy]-3-ethoxy-phenyl]propanoate Openeye Name: 3-[4-[2-(diethylammonio)ethoxy]-3-ethoxy-phenyl]propanoate CAS Name: 3-[4-[2-(diethylammonio)ethoxy]-3-ethoxyphenyl]propanoate IUPAC Name: 3-[4-[2-(diethylazaniumyl)ethoxy]-3-ethoxyphenyl]propanoate Traditional Name: 3-[4-[2-(diethylammonio)ethoxy]-3-ethoxy-phenyl]propionate Formula: C17H27NO4 MolecularWeight: 309.40058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO4/c1-4-18(5-2)11-12-22-15-9-7-14(8-10-17(19)20)13-16(15)21-6-3/h7,9,13H,4-6,8,10-12H2,1-3H3,(H,19,20)