(4-oxidanylidene-1H-quinazolin-2-yl)methyl (1R,5S)-9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl (1R,5S)-9-oxidanylidenebicyclo[3.3.1]nonane-3-carboxylate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl (1R,5S)-9-oxobicyclo[3.3.1]nonane-3-carboxylate CAS Name: (1R,5S)-9-oxo-3-bicyclo[3.3.1]nonanecarboxylic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl (1R,5S)-9-oxobicyclo[3.3.1]nonane-3-carboxylate Traditional Name: (1R,5S)-9-ketobicyclo[3.3.1]nonane-3-carboxylic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)C2=O)C(=O)OCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1C[C@@H]2CC(C[C@H](C1)C2=O)C(=O)OCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C19H20N2O4/c22-17-11-4-3-5-12(17)9-13(8-11)19(24)25-10-16-20-15-7-2-1-6-14(15)18(23)21-16/h1-2,6-7,11-13H,3-5,8-10H2,(H,20,21,23)/t11-,12+,13?