(3Z,5E)-1,1-dimethyl-3,5-bis[(E)-3-phenylprop-2-enylidene]piperidin-1-ium-4-one hydroiodide

Systemtic Name: (3Z,5E)-1,1-dimethyl-3,5-bis[(E)-3-phenylprop-2-enylidene]piperidin-1-ium-4-one hydroiodide Openeye Name: (3Z,5E)-1,1-dimethyl-3,5-bis[(E)-3-phenylprop-2-enylidene]piperidin-1-ium-4-one hydroiodide CAS Name: (3Z,5E)-1,1-dimethyl-3,5-bis[(E)-3-phenylprop-2-enylidene]-4-piperidin-1-iumone hydroiodide IUPAC Name: (3Z,5E)-1,1-dimethyl-3,5-bis[(E)-3-phenylprop-2-enylidene]piperidin-1-ium-4-one hydroiodide Traditional Name: (3Z,5E)-1,1-dimethyl-3,5-bis[(E)-3-phenylprop-2-enylidene]piperidin-1-ium-4-one hydroiodide Formula: C25H27INO+ MolecularWeight: 484.39245

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC(=CC=CC2=CC=CC=C2)C(=O)C(=CC=CC3=CC=CC=C3)C1)C.I

Isomeric SMILES

C[N+]1(C/C(=C\C=C\C2=CC=CC=C2)/C(=O)/C(=C\C=C\C3=CC=CC=C3)/C1)C.I

InChI

InChI=1S/C25H26NO.HI/c1-26(2)19-23(17-9-15-21-11-5-3-6-12-21)25(27)24(20-26)18-10-16-22-13-7-4-8-14-22;/h3-18H,19-20H2,1-2H3;1H/q+1;/b15-9+,16-10+,23-17-,24-18+;