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

Systemtic Name: 4-[(diethylazaniumyl)methyl]-2-methyl-5-(2-methylpropyl)furan-3-carboxylate Openeye Name: 4-[(diethylammonio)methyl]-5-isobutyl-2-methyl-furan-3-carboxylate CAS Name: 4-[(diethylammonio)methyl]-2-methyl-5-(2-methylpropyl)-3-furancarboxylate IUPAC Name: 4-[(diethylazaniumyl)methyl]-2-methyl-5-(2-methylpropyl)furan-3-carboxylate Traditional Name: 4-[(diethylammonio)methyl]-5-isobutyl-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)CC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO3/c1-6-16(7-2)9-12-13(8-10(3)4)19-11(5)14(12)15(17)18/h10H,6-9H2,1-5H3,(H,17,18)