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

Systemtic Name: (3Z,5E)-3,5-bis[(4-hydroxyphenyl)methylidene]-1-methyl-piperidin-1-ium-4-one Openeye Name: (3Z,5E)-3,5-bis[(4-hydroxyphenyl)methylene]-1-methyl-piperidin-1-ium-4-one CAS Name: (3Z,5E)-3,5-bis[(4-hydroxyphenyl)methylidene]-1-methyl-4-piperidin-1-iumone IUPAC Name: (3Z,5E)-3,5-bis[(4-hydroxyphenyl)methylidene]-1-methylpiperidin-1-ium-4-one Traditional Name: (3Z,5E)-3,5-bis(4-hydroxybenzylidene)-1-methyl-piperidin-1-ium-4-one Formula: C20H20NO3+ MolecularWeight: 322.3777

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO3/c1-21-12-16(10-14-2-6-18(22)7-3-14)20(24)17(13-21)11-15-4-8-19(23)9-5-15/h2-11,22-23H,12-13H2,1H3/p+1/b16-10-,17-11+