(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: (5-methyl-2-phenyl-oxazol-4-yl)methyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: 9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid (5-methyl-2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: 9-ketobicyclo[3.3.1]nonane-3-carboxylic acid (5-methyl-2-phenyl-oxazol-4-yl)methyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)C3CC4CCCC(C3)C4=O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)COC(=O)C3CC4CCCC(C3)C4=O

InChI

InChI=1S/C21H23NO4/c1-13-18(22-20(26-13)14-6-3-2-4-7-14)12-25-21(24)17-10-15-8-5-9-16(11-17)19(15)23/h2-4,6-7,15-17H,5,8-12H2,1H3