(3E,5E)-3,5-bis[(4-ethoxyphenyl)methylidene]-1-ethyl-piperidin-1-ium-4-one

Systemtic Name: (3E,5E)-3,5-bis[(4-ethoxyphenyl)methylidene]-1-ethyl-piperidin-1-ium-4-one Openeye Name: (3E,5E)-3,5-bis[(4-ethoxyphenyl)methylene]-1-ethyl-piperidin-1-ium-4-one CAS Name: (3E,5E)-3,5-bis[(4-ethoxyphenyl)methylidene]-1-ethyl-4-piperidin-1-iumone IUPAC Name: (3E,5E)-3,5-bis[(4-ethoxyphenyl)methylidene]-1-ethylpiperidin-1-ium-4-one Traditional Name: (3E,5E)-3,5-bis(4-ethoxybenzylidene)-1-ethyl-piperidin-1-ium-4-one Formula: C25H30NO3+ MolecularWeight: 392.5106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29NO3/c1-4-26-17-21(15-19-7-11-23(12-8-19)28-5-2)25(27)22(18-26)16-20-9-13-24(14-10-20)29-6-3/h7-16H,4-6,17-18H2,1-3H3/p+1/b21-15+,22-16+