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

Systemtic Name: (3E,5E)-1-methyl-3,5-bis[(2-methylphenyl)methylidene]piperidin-1-ium-4-one Openeye Name: (3E,5E)-1-methyl-3,5-bis(o-tolylmethylene)piperidin-1-ium-4-one CAS Name: (3E,5E)-1-methyl-3,5-bis[(2-methylphenyl)methylidene]-4-piperidin-1-iumone IUPAC Name: (3E,5E)-1-methyl-3,5-bis[(2-methylphenyl)methylidene]piperidin-1-ium-4-one Traditional Name: (3E,5E)-1-methyl-3,5-bis(2-methylbenzylidene)piperidin-1-ium-4-one Formula: C22H24NO+ MolecularWeight: 318.43206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C2C[NH+](CC(=CC3=CC=CC=C3C)C2=O)C

Isomeric SMILES

CC1=CC=CC=C1/C=C\2/C(=O)/C(=C/C3=CC=CC=C3C)/C[NH+](C2)C

InChI

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