(3E)-1-(phenylmethyl)-3,5-bis(thiophen-2-ylmethylidene)piperidin-1-ium-4-one

Systemtic Name: (3E)-1-(phenylmethyl)-3,5-bis(thiophen-2-ylmethylidene)piperidin-1-ium-4-one Openeye Name: (3E)-1-benzyl-3,5-bis(2-thienylmethylene)piperidin-1-ium-4-one CAS Name: (3E)-1-(phenylmethyl)-3,5-bis(thiophen-2-ylmethylidene)-4-piperidin-1-iumone IUPAC Name: (3E)-1-benzyl-3,5-bis(thiophen-2-ylmethylidene)piperidin-1-ium-4-one Traditional Name: (3E)-1-benzyl-3,5-bis(2-thenylidene)piperidin-1-ium-4-one Formula: C22H20NOS2+ MolecularWeight: 378.5303

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC=CS2)C(=O)C(=CC3=CC=CS3)C[NH+]1CC4=CC=CC=C4

Isomeric SMILES

C1C(=CC2=CC=CS2)C(=O)/C(=C/C3=CC=CS3)/C[NH+]1CC4=CC=CC=C4

InChI

InChI=1S/C22H19NOS2/c24-22-18(12-20-8-4-10-25-20)15-23(14-17-6-2-1-3-7-17)16-19(22)13-21-9-5-11-26-21/h1-13H,14-16H2/p+1/b18-12+,19-13?