1,1,2-trimethyl-4,4-diphenyl-piperidin-1-ium-3-one bromide

Systemtic Name: 1,1,2-trimethyl-4,4-diphenyl-piperidin-1-ium-3-one bromide Openeye Name: 1,1,2-trimethyl-4,4-diphenyl-piperidin-1-ium-3-one bromide CAS Name: 1,1,2-trimethyl-4,4-diphenyl-3-piperidin-1-iumone bromide IUPAC Name: 1,1,2-trimethyl-4,4-diphenylpiperidin-1-ium-3-one bromide Traditional Name: 1,1,2-trimethyl-4,4-diphenyl-piperidin-1-ium-3-one bromide Formula: C20H24BrNO MolecularWeight: 374.31466

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C(CC[N+]1(C)C)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC1C(=O)C(CC[N+]1(C)C)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C20H24NO.BrH/c1-16-19(22)20(14-15-21(16,2)3,17-10-6-4-7-11-17)18-12-8-5-9-13-18;/h4-13,16H,14-15H2,1-3H3;1H/q+1;/p-1