(2S,3R,5S,6R)-1,1,3,5-tetramethyl-2,6-diphenyl-piperidin-1-ium-4-one

Systemtic Name: (2S,3R,5S,6R)-1,1,3,5-tetramethyl-2,6-diphenyl-piperidin-1-ium-4-one Openeye Name: (2S,3R,5S,6R)-1,1,3,5-tetramethyl-2,6-diphenyl-piperidin-1-ium-4-one CAS Name: (2S,3R,5S,6R)-1,1,3,5-tetramethyl-2,6-diphenyl-4-piperidin-1-iumone IUPAC Name: (2S,3R,5S,6R)-1,1,3,5-tetramethyl-2,6-diphenylpiperidin-1-ium-4-one Traditional Name: (2S,3R,5S,6R)-1,1,3,5-tetramethyl-2,6-diphenyl-piperidin-1-ium-4-one Formula: C21H26NO+ MolecularWeight: 308.43724

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Descriptors Computed from Structure

Canonical SMILES:

CC1C([N+](C(C(C1=O)C)C2=CC=CC=C2)(C)C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1[C@H]([N+]([C@H]([C@@H](C1=O)C)C2=CC=CC=C2)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C21H26NO/c1-15-19(17-11-7-5-8-12-17)22(3,4)20(16(2)21(15)23)18-13-9-6-10-14-18/h5-16,19-20H,1-4H3/q+1/t15-,16+,19+,20-