methyl 2-butyl-1-chloranyl-imidazole-4-carboxylate

Systemtic Name: methyl 2-butyl-1-chloranyl-imidazole-4-carboxylate Openeye Name: methyl 2-butyl-1-chloro-imidazole-4-carboxylate CAS Name: 2-butyl-1-chloro-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-butyl-1-chloroimidazole-4-carboxylate Traditional Name: 2-butyl-1-chloro-imidazole-4-carboxylic acid methyl ester Formula: C9H13ClN2O2 MolecularWeight: 216.66472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CN1Cl)C(=O)OC

Isomeric SMILES

CCCCC1=NC(=CN1Cl)C(=O)OC

InChI

InChI=1S/C9H13ClN2O2/c1-3-4-5-8-11-7(6-12(8)10)9(13)14-2/h6H,3-5H2,1-2H3