5-[(1R)-1-(dibutylazaniumyl)ethyl]furan-2-carboxylate

Systemtic Name: 5-[(1R)-1-(dibutylazaniumyl)ethyl]furan-2-carboxylate Openeye Name: 5-[(1R)-1-(dibutylammonio)ethyl]furan-2-carboxylate CAS Name: 5-[(1R)-1-(dibutylammonio)ethyl]-2-furancarboxylate IUPAC Name: 5-[(1R)-1-(dibutylazaniumyl)ethyl]furan-2-carboxylate Traditional Name: 5-[(1R)-1-(dibutylammonio)ethyl]-2-furoate Formula: C15H25NO3 MolecularWeight: 267.3639

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO3/c1-4-6-10-16(11-7-5-2)12(3)13-8-9-14(19-13)15(17)18/h8-9,12H,4-7,10-11H2,1-3H3,(H,17,18)/t12-/m1/s1