5-[(1R)-1-[tert-butyl(ethyl)azaniumyl]ethyl]furan-2-carboxylate

Systemtic Name: 5-[(1R)-1-[tert-butyl(ethyl)azaniumyl]ethyl]furan-2-carboxylate Openeye Name: 5-[(1R)-1-[tert-butyl(ethyl)ammonio]ethyl]furan-2-carboxylate CAS Name: 5-[(1R)-1-[tert-butyl(ethyl)ammonio]ethyl]-2-furancarboxylate IUPAC Name: 5-[(1R)-1-[tert-butyl(ethyl)azaniumyl]ethyl]furan-2-carboxylate Traditional Name: 5-[(1R)-1-[tert-butyl(ethyl)ammonio]ethyl]-2-furoate Formula: C13H21NO3 MolecularWeight: 239.31074

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](C(C)C1=CC=C(O1)C(=O)[O-])C(C)(C)C

Isomeric SMILES

CC[NH+]([C@H](C)C1=CC=C(O1)C(=O)[O-])C(C)(C)C

InChI

InChI=1S/C13H21NO3/c1-6-14(13(3,4)5)9(2)10-7-8-11(17-10)12(15)16/h7-9H,6H2,1-5H3,(H,15,16)/t9-/m1/s1