1-butyl-3-methyl-imidazol-3-ium-2-carboxylate

Systemtic Name: 1-butyl-3-methyl-imidazol-3-ium-2-carboxylate Openeye Name: 1-butyl-3-methyl-imidazol-3-ium-2-carboxylate CAS Name: 1-butyl-3-methyl-2-imidazol-3-iumcarboxylate IUPAC Name: 1-butyl-3-methylimidazol-3-ium-2-carboxylate Traditional Name: 1-butyl-3-methyl-imidazol-3-ium-2-carboxylate Formula: C9H14N2O2 MolecularWeight: 182.21966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1C(=O)[O-])C

Isomeric SMILES

CCCCN1C=C[N+](=C1C(=O)[O-])C

InChI

InChI=1S/C9H14N2O2/c1-3-4-5-11-7-6-10(2)8(11)9(12)13/h6-7H,3-5H2,1-2H3