(5-chloranyl-1-methyl-imidazol-2-yl)methyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: (5-chloranyl-1-methyl-imidazol-2-yl)methyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: (5-chloro-1-methyl-imidazol-2-yl)methyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid (5-chloro-1-methyl-2-imidazolyl)methyl ester IUPAC Name: (5-chloro-1-methylimidazol-2-yl)methyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 9-ketobicyclo[3.3.1]nonane-3-carboxylic acid (5-chloro-1-methyl-imidazol-2-yl)methyl ester Formula: C15H19ClN2O3 MolecularWeight: 310.77596

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC(=O)C2CC3CCCC(C2)C3=O)Cl

Isomeric SMILES

CN1C(=CN=C1COC(=O)C2CC3CCCC(C2)C3=O)Cl

InChI

InChI=1S/C15H19ClN2O3/c1-18-12(16)7-17-13(18)8-21-15(20)11-5-9-3-2-4-10(6-11)14(9)19/h7,9-11H,2-6,8H2,1H3