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

Systemtic Name: (3E)-3,5-bis[(5-methylfuran-2-yl)methylidene]-1-(phenylmethyl)piperidin-1-ium-4-one Openeye Name: (3E)-1-benzyl-3,5-bis[(5-methyl-2-furyl)methylene]piperidin-1-ium-4-one CAS Name: (3E)-3,5-bis[(5-methyl-2-furanyl)methylidene]-1-(phenylmethyl)-4-piperidin-1-iumone IUPAC Name: (3E)-1-benzyl-3,5-bis[(5-methylfuran-2-yl)methylidene]piperidin-1-ium-4-one Traditional Name: (3E)-1-benzyl-3,5-bis[(5-methyl-2-furyl)methylene]piperidin-1-ium-4-one Formula: C24H24NO3+ MolecularWeight: 374.45226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=C2C[NH+](CC(=CC3=CC=C(O3)C)C2=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)C=C2C[NH+](C/C(=C\C3=CC=C(O3)C)/C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H23NO3/c1-17-8-10-22(27-17)12-20-15-25(14-19-6-4-3-5-7-19)16-21(24(20)26)13-23-11-9-18(2)28-23/h3-13H,14-16H2,1-2H3/p+1/b20-12+,21-13?