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

Systemtic Name: (3E)-1-methyl-3,5-bis[(2,3,4-trimethoxyphenyl)methylidene]piperidin-1-ium-4-one Openeye Name: (3E)-1-methyl-3,5-bis[(2,3,4-trimethoxyphenyl)methylene]piperidin-1-ium-4-one CAS Name: (3E)-1-methyl-3,5-bis[(2,3,4-trimethoxyphenyl)methylidene]-4-piperidin-1-iumone IUPAC Name: (3E)-1-methyl-3,5-bis[(2,3,4-trimethoxyphenyl)methylidene]piperidin-1-ium-4-one Traditional Name: (3E)-1-methyl-3,5-bis(2,3,4-trimethoxybenzylidene)piperidin-1-ium-4-one Formula: C26H32NO7+ MolecularWeight: 470.53478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31NO7/c1-27-14-18(12-16-8-10-20(29-2)25(33-6)23(16)31-4)22(28)19(15-27)13-17-9-11-21(30-3)26(34-7)24(17)32-5/h8-13H,14-15H2,1-7H3/p+1/b18-12+,19-13?