(3E)-3,5-bis[(2,4-dimethylphenyl)methylidene]-1-methyl-piperidin-1-ium-4-one

Systemtic Name: (3E)-3,5-bis[(2,4-dimethylphenyl)methylidene]-1-methyl-piperidin-1-ium-4-one Openeye Name: (3E)-3,5-bis[(2,4-dimethylphenyl)methylene]-1-methyl-piperidin-1-ium-4-one CAS Name: (3E)-3,5-bis[(2,4-dimethylphenyl)methylidene]-1-methyl-4-piperidin-1-iumone IUPAC Name: (3E)-3,5-bis[(2,4-dimethylphenyl)methylidene]-1-methylpiperidin-1-ium-4-one Traditional Name: (3E)-3,5-bis(2,4-dimethylbenzylidene)-1-methyl-piperidin-1-ium-4-one Formula: C24H28NO+ MolecularWeight: 346.48522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C=C2C[NH+](CC(=CC3=C(C=C(C=C3)C)C)C2=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C=C2C[NH+](C/C(=C\C3=C(C=C(C=C3)C)C)/C2=O)C)C

InChI

InChI=1S/C24H27NO/c1-16-6-8-20(18(3)10-16)12-22-14-25(5)15-23(24(22)26)13-21-9-7-17(2)11-19(21)4/h6-13H,14-15H2,1-5H3/p+1/b22-12+,23-13?