5-[[tert-butyl(ethyl)azaniumyl]methyl]furan-2-carboxylate

Systemtic Name: 5-[[tert-butyl(ethyl)azaniumyl]methyl]furan-2-carboxylate Openeye Name: 5-[[tert-butyl(ethyl)ammonio]methyl]furan-2-carboxylate CAS Name: 5-[[tert-butyl(ethyl)ammonio]methyl]-2-furancarboxylate IUPAC Name: 5-[[tert-butyl(ethyl)azaniumyl]methyl]furan-2-carboxylate Traditional Name: 5-[[tert-butyl(ethyl)ammonio]methyl]-2-furoate Formula: C12H19NO3 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO3/c1-5-13(12(2,3)4)8-9-6-7-10(16-9)11(14)15/h6-7H,5,8H2,1-4H3,(H,14,15)