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

Systemtic Name: (3E)-1-methyl-3,5-bis[(4-methylphenyl)methylidene]piperidin-1-ium-4-one Openeye Name: (3E)-1-methyl-3,5-bis(p-tolylmethylene)piperidin-1-ium-4-one CAS Name: (3E)-1-methyl-3,5-bis[(4-methylphenyl)methylidene]-4-piperidin-1-iumone IUPAC Name: (3E)-1-methyl-3,5-bis[(4-methylphenyl)methylidene]piperidin-1-ium-4-one Traditional Name: (3E)-1-methyl-3,5-bis(4-methylbenzylidene)piperidin-1-ium-4-one Formula: C22H24NO+ MolecularWeight: 318.43206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO/c1-16-4-8-18(9-5-16)12-20-14-23(3)15-21(22(20)24)13-19-10-6-17(2)7-11-19/h4-13H,14-15H2,1-3H3/p+1/b20-12+,21-13?