1,3-benzoxazol-2-ylmethyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: 1,3-benzoxazol-2-ylmethyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: 1,3-benzoxazol-2-ylmethyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid 1,3-benzoxazol-2-ylmethyl ester IUPAC Name: 1,3-benzoxazol-2-ylmethyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 9-ketobicyclo[3.3.1]nonane-3-carboxylic acid 1,3-benzoxazol-2-ylmethyl ester Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)C2=O)C(=O)OCC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CC2CC(CC(C1)C2=O)C(=O)OCC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C18H19NO4/c20-17-11-4-3-5-12(17)9-13(8-11)18(21)22-10-16-19-14-6-1-2-7-15(14)23-16/h1-2,6-7,11-13H,3-5,8-10H2