(2R,5S)-1,5-dimethyl-2-phenyl-piperidin-1-ium-4-one

Systemtic Name: (2R,5S)-1,5-dimethyl-2-phenyl-piperidin-1-ium-4-one Openeye Name: (2R,5S)-1,5-dimethyl-2-phenyl-piperidin-1-ium-4-one CAS Name: (2R,5S)-1,5-dimethyl-2-phenyl-4-piperidin-1-iumone IUPAC Name: (2R,5S)-1,5-dimethyl-2-phenylpiperidin-1-ium-4-one Traditional Name: (2R,5S)-1,5-dimethyl-2-phenyl-piperidin-1-ium-4-one Formula: C13H18NO+ MolecularWeight: 204.28812

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](C(CC1=O)C2=CC=CC=C2)C

Isomeric SMILES

C[C@H]1C[NH+]([C@H](CC1=O)C2=CC=CC=C2)C

InChI

InChI=1S/C13H17NO/c1-10-9-14(2)12(8-13(10)15)11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3/p+1/t10-,12+/m0/s1