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

Systemtic Name: (3E,5E)-3,5-bis[(4-ethoxyphenyl)methylidene]-1-propan-2-yl-piperidin-1-ium-4-one Openeye Name: (3E,5E)-3,5-bis[(4-ethoxyphenyl)methylene]-1-isopropyl-piperidin-1-ium-4-one CAS Name: (3E,5E)-3,5-bis[(4-ethoxyphenyl)methylidene]-1-propan-2-yl-4-piperidin-1-iumone IUPAC Name: (3E,5E)-3,5-bis[(4-ethoxyphenyl)methylidene]-1-propan-2-ylpiperidin-1-ium-4-one Traditional Name: (3E,5E)-3,5-bis(4-ethoxybenzylidene)-1-isopropyl-piperidin-1-ium-4-one Formula: C26H32NO3+ MolecularWeight: 406.53718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C2C[NH+](CC(=CC3=CC=C(C=C3)OCC)C2=O)C(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C\2/C(=O)/C(=C/C3=CC=C(C=C3)OCC)/C[NH+](C2)C(C)C

InChI

InChI=1S/C26H31NO3/c1-5-29-24-11-7-20(8-12-24)15-22-17-27(19(3)4)18-23(26(22)28)16-21-9-13-25(14-10-21)30-6-2/h7-16,19H,5-6,17-18H2,1-4H3/p+1/b22-15+,23-16+