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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C([NH2+]C(C(C1=O)CC)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC[C@@H]1[C@@H]([NH2+][C@H]([C@@H](C1=O)CC)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO/c1-3-17-19(15-11-7-5-8-12-15)22-20(18(4-2)21(17)23)16-13-9-6-10-14-16/h5-14,17-20,22H,3-4H2,1-2H3/p+1/t17-,18+,19-,20-/m0/s1