4,5-dimethyl-3-oxidanylidene-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: 4,5-dimethyl-3-oxidanylidene-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: 8-benzyl-4,5-dimethyl-3-oxo-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: 4,5-dimethyl-3-oxo-8-(phenylmethyl)-8-azabicyclo[3.2.1]octane-4-carboxylate IUPAC Name: 8-benzyl-4,5-dimethyl-3-oxo-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: 8-benzyl-3-keto-4,5-dimethyl-8-azabicyclo[3.2.1]octane-4-carboxylate Formula: C17H20NO3- MolecularWeight: 286.3456

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(N1CC3=CC=CC=C3)CC(=O)C2(C)C(=O)[O-]

Isomeric SMILES

CC12CCC(N1CC3=CC=CC=C3)CC(=O)C2(C)C(=O)[O-]

InChI

InChI=1S/C17H21NO3/c1-16-9-8-13(10-14(19)17(16,2)15(20)21)18(16)11-12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3,(H,20,21)/p-1