2-butyl-5-chloranyl-3-methyl-imidazole-4-carboxylic acid

Systemtic Name: 2-butyl-5-chloranyl-3-methyl-imidazole-4-carboxylic acid Openeye Name: 2-butyl-5-chloro-3-methyl-imidazole-4-carboxylic acid CAS Name: 2-butyl-5-chloro-3-methyl-4-imidazolecarboxylic acid IUPAC Name: 2-butyl-5-chloro-3-methylimidazole-4-carboxylic acid Traditional Name: 2-butyl-5-chloro-3-methyl-imidazole-4-carboxylic acid Formula: C9H13ClN2O2 MolecularWeight: 216.66472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1C)C(=O)O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1C)C(=O)O)Cl

InChI

InChI=1S/C9H13ClN2O2/c1-3-4-5-6-11-8(10)7(9(13)14)12(6)2/h3-5H2,1-2H3,(H,13,14)