5-[(diethylazaniumyl)methyl]-2-phenyl-furan-3-carboxylate

Systemtic Name: 5-[(diethylazaniumyl)methyl]-2-phenyl-furan-3-carboxylate Openeye Name: 5-[(diethylammonio)methyl]-2-phenyl-furan-3-carboxylate CAS Name: 5-[(diethylammonio)methyl]-2-phenyl-3-furancarboxylate IUPAC Name: 5-[(diethylazaniumyl)methyl]-2-phenylfuran-3-carboxylate Traditional Name: 5-[(diethylammonio)methyl]-2-phenyl-3-furoate Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC(=C(O1)C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CC1=CC(=C(O1)C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C16H19NO3/c1-3-17(4-2)11-13-10-14(16(18)19)15(20-13)12-8-6-5-7-9-12/h5-10H,3-4,11H2,1-2H3,(H,18,19)