sodium 5-pentyl-1H-imidazole-2-carboxylate

Systemtic Name: sodium 5-pentyl-1H-imidazole-2-carboxylate Openeye Name: sodium 5-pentyl-1H-imidazole-2-carboxylate CAS Name: sodium 5-pentyl-1H-imidazole-2-carboxylate IUPAC Name: sodium 5-pentyl-1H-imidazole-2-carboxylate Traditional Name: sodium 5-amyl-1H-imidazole-2-carboxylate Formula: C9H13N2NaO2 MolecularWeight: 204.20149

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N1)C(=O)[O-].[Na+]

Isomeric SMILES

CCCCCC1=CN=C(N1)C(=O)[O-].[Na+]

InChI

InChI=1S/C9H14N2O2.Na/c1-2-3-4-5-7-6-10-8(11-7)9(12)13;/h6H,2-5H2,1H3,(H,10,11)(H,12,13);/q;+1/p-1