furan-2-ylmethyl(1-phenylpropan-2-yl)azanium ethanoate

Systemtic Name: furan-2-ylmethyl(1-phenylpropan-2-yl)azanium ethanoate Openeye Name: 2-furylmethyl-(1-methyl-2-phenyl-ethyl)ammonium acetate CAS Name: 2-furanylmethyl(1-phenylpropan-2-yl)ammonium acetate IUPAC Name: furan-2-ylmethyl(1-phenylpropan-2-yl)azanium acetate Traditional Name: 2-furfuryl-(1-methyl-2-phenyl-ethyl)ammonium acetate Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)[NH2+]CC2=CC=CO2.CC(=O)[O-]

Isomeric SMILES

CC(CC1=CC=CC=C1)[NH2+]CC2=CC=CO2.CC(=O)[O-]

InChI

InChI=1S/C14H17NO.C2H4O2/c1-12(10-13-6-3-2-4-7-13)15-11-14-8-5-9-16-14;1-2(3)4/h2-9,12,15H,10-11H2,1H3;1H3,(H,3,4)