(2-acetamido-1,3-thiazol-4-yl)methyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: (2-acetamidothiazol-4-yl)methyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 9-ketobicyclo[3.3.1]nonane-3-carboxylic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2CC3CCCC(C2)C3=O

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2CC3CCCC(C2)C3=O

InChI

InChI=1S/C16H20N2O4S/c1-9(19)17-16-18-13(8-23-16)7-22-15(21)12-5-10-3-2-4-11(6-12)14(10)20/h8,10-12H,2-7H2,1H3,(H,17,18,19)