3-[2-(4-methylphenoxy)ethylazaniumyl]propanoate

Systemtic Name: 3-[2-(4-methylphenoxy)ethylazaniumyl]propanoate Openeye Name: 3-[2-(4-methylphenoxy)ethylammonio]propanoate CAS Name: 3-[2-(4-methylphenoxy)ethylammonio]propanoate IUPAC Name: 3-[2-(4-methylphenoxy)ethylazaniumyl]propanoate Traditional Name: 3-[2-(4-methylphenoxy)ethylammonio]propionate Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC[NH2+]CCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCC[NH2+]CCC(=O)[O-]

InChI

InChI=1S/C12H17NO3/c1-10-2-4-11(5-3-10)16-9-8-13-7-6-12(14)15/h2-5,13H,6-9H2,1H3,(H,14,15)