(2R,3R,6R)-2,6-diphenyl-3-propyl-piperidin-1-ium-4-one

Systemtic Name: (2R,3R,6R)-2,6-diphenyl-3-propyl-piperidin-1-ium-4-one Openeye Name: (2R,3R,6R)-2,6-diphenyl-3-propyl-piperidin-1-ium-4-one CAS Name: (2R,3R,6R)-2,6-diphenyl-3-propyl-4-piperidin-1-iumone IUPAC Name: (2R,3R,6R)-2,6-diphenyl-3-propylpiperidin-1-ium-4-one Traditional Name: (2R,3R,6R)-2,6-diphenyl-3-propyl-piperidin-1-ium-4-one Formula: C20H24NO+ MolecularWeight: 294.41066

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C([NH2+]C(CC1=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCC[C@@H]1[C@@H]([NH2+][C@H](CC1=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H23NO/c1-2-9-17-19(22)14-18(15-10-5-3-6-11-15)21-20(17)16-12-7-4-8-13-16/h3-8,10-13,17-18,20-21H,2,9,14H2,1H3/p+1/t17-,18+,20-/m0/s1