5-tert-butyl-4-[(diethylazaniumyl)methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: 5-tert-butyl-4-[(diethylazaniumyl)methyl]-2-methyl-furan-3-carboxylate Openeye Name: 5-tert-butyl-4-[(diethylammonio)methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-tert-butyl-4-[(diethylammonio)methyl]-2-methyl-3-furancarboxylate IUPAC Name: 5-tert-butyl-4-[(diethylazaniumyl)methyl]-2-methylfuran-3-carboxylate Traditional Name: 5-tert-butyl-4-[(diethylammonio)methyl]-2-methyl-3-furoate Formula: C15H25NO3 MolecularWeight: 267.3639

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(OC(=C1C(=O)[O-])C)C(C)(C)C

Isomeric SMILES

CC[NH+](CC)CC1=C(OC(=C1C(=O)[O-])C)C(C)(C)C

InChI

InChI=1S/C15H25NO3/c1-7-16(8-2)9-11-12(14(17)18)10(3)19-13(11)15(4,5)6/h7-9H2,1-6H3,(H,17,18)