(3Z,5E)-3,5-bis[(3-bromophenyl)methylidene]-1-methyl-piperidin-1-ium-4-one

Systemtic Name: (3Z,5E)-3,5-bis[(3-bromophenyl)methylidene]-1-methyl-piperidin-1-ium-4-one Openeye Name: (3Z,5E)-3,5-bis[(3-bromophenyl)methylene]-1-methyl-piperidin-1-ium-4-one CAS Name: (3Z,5E)-3,5-bis[(3-bromophenyl)methylidene]-1-methyl-4-piperidin-1-iumone IUPAC Name: (3Z,5E)-3,5-bis[(3-bromophenyl)methylidene]-1-methylpiperidin-1-ium-4-one Traditional Name: (3Z,5E)-3,5-bis(3-bromobenzylidene)-1-methyl-piperidin-1-ium-4-one Formula: C20H18Br2NO+ MolecularWeight: 448.17102

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC(=CC2=CC(=CC=C2)Br)C(=O)C(=CC3=CC(=CC=C3)Br)C1

Isomeric SMILES

C[NH+]1C/C(=C\C2=CC(=CC=C2)Br)/C(=O)/C(=C\C3=CC(=CC=C3)Br)/C1

InChI

InChI=1S/C20H17Br2NO/c1-23-12-16(8-14-4-2-6-18(21)10-14)20(24)17(13-23)9-15-5-3-7-19(22)11-15/h2-11H,12-13H2,1H3/p+1/b16-8-,17-9+