(3E,5E)-3,5-bis[(3-bromophenyl)methylidene]-1-propan-2-yl-piperidin-1-ium-4-one

Systemtic Name: (3E,5E)-3,5-bis[(3-bromophenyl)methylidene]-1-propan-2-yl-piperidin-1-ium-4-one Openeye Name: (3E,5E)-3,5-bis[(3-bromophenyl)methylene]-1-isopropyl-piperidin-1-ium-4-one CAS Name: (3E,5E)-3,5-bis[(3-bromophenyl)methylidene]-1-propan-2-yl-4-piperidin-1-iumone IUPAC Name: (3E,5E)-3,5-bis[(3-bromophenyl)methylidene]-1-propan-2-ylpiperidin-1-ium-4-one Traditional Name: (3E,5E)-3,5-bis(3-bromobenzylidene)-1-isopropyl-piperidin-1-ium-4-one Formula: C22H22Br2NO+ MolecularWeight: 476.22418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21Br2NO/c1-15(2)25-13-18(9-16-5-3-7-20(23)11-16)22(26)19(14-25)10-17-6-4-8-21(24)12-17/h3-12,15H,13-14H2,1-2H3/p+1/b18-9+,19-10+