methyl (1R,4R,8S)-4,6-dimethyl-8-phenyl-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate

Systemtic Name: methyl (1R,4R,8S)-4,6-dimethyl-8-phenyl-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate Openeye Name: methyl (1R,4R,8S)-4,6-dimethyl-8-phenyl-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate CAS Name: (1R,4R,8S)-4,6-dimethyl-8-phenyl-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,4R,8S)-4,6-dimethyl-8-phenyl-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate Traditional Name: (1R,4R,8S)-4,6-dimethyl-8-phenyl-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylic acid methyl ester Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2(CN(C1CC2C3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CC1=C[C@]2(CN([C@@H]1C[C@H]2C3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C17H21NO2/c1-12-10-17(2)11-18(16(19)20-3)15(12)9-14(17)13-7-5-4-6-8-13/h4-8,10,14-15H,9,11H2,1-3H3/t14-,15+,17-/m0/s1