(phenylmethyl) (1S,5S)-6,7-dimethyl-3-oxidanylidene-9-azabicyclo[3.3.1]non-6-ene-9-carboxylate

Systemtic Name: (phenylmethyl) (1S,5S)-6,7-dimethyl-3-oxidanylidene-9-azabicyclo[3.3.1]non-6-ene-9-carboxylate Openeye Name: benzyl (1S,5S)-6,7-dimethyl-3-oxo-9-azabicyclo[3.3.1]non-6-ene-9-carboxylate CAS Name: (1S,5S)-6,7-dimethyl-3-oxo-9-azabicyclo[3.3.1]non-6-ene-9-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1S,5S)-6,7-dimethyl-3-oxo-9-azabicyclo[3.3.1]non-6-ene-9-carboxylate Traditional Name: (1S,5S)-3-keto-6,7-dimethyl-9-azabicyclo[3.3.1]non-6-ene-9-carboxylic acid benzyl ester Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2CC(=O)CC(C1)N2C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C([C@@H]2CC(=O)C[C@H](C1)N2C(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C18H21NO3/c1-12-8-15-9-16(20)10-17(13(12)2)19(15)18(21)22-11-14-6-4-3-5-7-14/h3-7,15,17H,8-11H2,1-2H3/t15-,17-/m0/s1