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

Systemtic Name: 2-[(3-ethoxyphenyl)methyl-phenethyl-azaniumyl]ethanoate Openeye Name: 2-[(3-ethoxyphenyl)methyl-phenethyl-ammonio]acetate CAS Name: 2-[(3-ethoxyphenyl)methyl-phenethylammonio]acetate IUPAC Name: 2-[(3-ethoxyphenyl)methyl-phenethylazaniumyl]acetate Traditional Name: 2-[(3-ethoxybenzyl)-phenethyl-ammonio]acetate Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C[NH+](CCC2=CC=CC=C2)CC(=O)[O-]

Isomeric SMILES

CCOC1=CC=CC(=C1)C[NH+](CCC2=CC=CC=C2)CC(=O)[O-]

InChI

InChI=1S/C19H23NO3/c1-2-23-18-10-6-9-17(13-18)14-20(15-19(21)22)12-11-16-7-4-3-5-8-16/h3-10,13H,2,11-12,14-15H2,1H3,(H,21,22)