(phenylmethyl) (1R,4R,5S)-4-ethyl-3-oxidanylidene-9-azabicyclo[3.3.1]nonane-9-carboxylate

Systemtic Name: (phenylmethyl) (1R,4R,5S)-4-ethyl-3-oxidanylidene-9-azabicyclo[3.3.1]nonane-9-carboxylate Openeye Name: benzyl (1R,4R,5S)-4-ethyl-3-oxo-9-azabicyclo[3.3.1]nonane-9-carboxylate CAS Name: (1R,4R,5S)-4-ethyl-3-oxo-9-azabicyclo[3.3.1]nonane-9-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1R,4R,5S)-4-ethyl-3-oxo-9-azabicyclo[3.3.1]nonane-9-carboxylate Traditional Name: (1R,4R,5S)-4-ethyl-3-keto-9-azabicyclo[3.3.1]nonane-9-carboxylic acid benzyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2CCCC(N2C(=O)OCC3=CC=CC=C3)CC1=O

Isomeric SMILES

CC[C@@H]1[C@@H]2CCC[C@@H](N2C(=O)OCC3=CC=CC=C3)CC1=O

InChI

InChI=1S/C18H23NO3/c1-2-15-16-10-6-9-14(11-17(15)20)19(16)18(21)22-12-13-7-4-3-5-8-13/h3-5,7-8,14-16H,2,6,9-12H2,1H3/t14-,15-,16+/m1/s1