methyl (1S,5S)-2-phenyl-8-(phenylcarbonyl)-8-azabicyclo[3.2.1]octane-5-carboxylate

Systemtic Name: methyl (1S,5S)-2-phenyl-8-(phenylcarbonyl)-8-azabicyclo[3.2.1]octane-5-carboxylate Openeye Name: methyl (1S,5S)-8-benzoyl-2-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylate CAS Name: (1S,5S)-8-benzoyl-2-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylic acid methyl ester IUPAC Name: methyl (1S,5S)-8-benzoyl-2-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylate Traditional Name: (1S,5S)-8-benzoyl-2-phenyl-8-azabicyclo[3.2.1]octane-5-carboxylic acid methyl ester Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C12CCC(C(N1C(=O)C3=CC=CC=C3)CC2)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@]12CC[C@H](N1C(=O)C3=CC=CC=C3)C(CC2)C4=CC=CC=C4

InChI

InChI=1S/C22H23NO3/c1-26-21(25)22-14-12-18(16-8-4-2-5-9-16)19(13-15-22)23(22)20(24)17-10-6-3-7-11-17/h2-11,18-19H,12-15H2,1H3/t18?,19-,22-/m0/s1