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

Systemtic Name: (3E,5E)-3,5-bis[(E)-3-phenylprop-2-enylidene]-1-propan-2-yl-piperidin-1-ium-4-one Openeye Name: (3E,5E)-1-isopropyl-3,5-bis[(E)-3-phenylprop-2-enylidene]piperidin-1-ium-4-one CAS Name: (3E,5E)-3,5-bis[(E)-3-phenylprop-2-enylidene]-1-propan-2-yl-4-piperidin-1-iumone IUPAC Name: (3E,5E)-3,5-bis[(E)-3-phenylprop-2-enylidene]-1-propan-2-ylpiperidin-1-ium-4-one Traditional Name: (3E,5E)-1-isopropyl-3,5-bis[(E)-3-phenylprop-2-enylidene]piperidin-1-ium-4-one Formula: C26H28NO+ MolecularWeight: 370.50662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27NO/c1-21(2)27-19-24(17-9-15-22-11-5-3-6-12-22)26(28)25(20-27)18-10-16-23-13-7-4-8-14-23/h3-18,21H,19-20H2,1-2H3/p+1/b15-9+,16-10+,24-17+,25-18+