2-[(3-ethoxyphenyl)methyl-propyl-azaniumyl]ethanoate

Systemtic Name: 2-[(3-ethoxyphenyl)methyl-propyl-azaniumyl]ethanoate Openeye Name: 2-[(3-ethoxyphenyl)methyl-propyl-ammonio]acetate CAS Name: 2-[(3-ethoxyphenyl)methyl-propylammonio]acetate IUPAC Name: 2-[(3-ethoxyphenyl)methyl-propylazaniumyl]acetate Traditional Name: 2-[(3-ethoxybenzyl)-propyl-ammonio]acetate Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO3/c1-3-8-15(11-14(16)17)10-12-6-5-7-13(9-12)18-4-2/h5-7,9H,3-4,8,10-11H2,1-2H3,(H,16,17)