2-[(3-ethoxyphenyl)methyl-(furan-2-ylmethyl)azaniumyl]ethanoate

Systemtic Name: 2-[(3-ethoxyphenyl)methyl-(furan-2-ylmethyl)azaniumyl]ethanoate Openeye Name: 2-[(3-ethoxyphenyl)methyl-(2-furylmethyl)ammonio]acetate CAS Name: 2-[(3-ethoxyphenyl)methyl-(2-furanylmethyl)ammonio]acetate IUPAC Name: 2-[(3-ethoxyphenyl)methyl-(furan-2-ylmethyl)azaniumyl]acetate Traditional Name: 2-[(3-ethoxybenzyl)-(2-furfuryl)ammonio]acetate Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C[NH+](CC2=CC=CO2)CC(=O)[O-]

Isomeric SMILES

CCOC1=CC=CC(=C1)C[NH+](CC2=CC=CO2)CC(=O)[O-]

InChI

InChI=1S/C16H19NO4/c1-2-20-14-6-3-5-13(9-14)10-17(12-16(18)19)11-15-7-4-8-21-15/h3-9H,2,10-12H2,1H3,(H,18,19)