(3Z,5E)-3-(phenylmethylidene)-1-(thiophen-2-ylmethyl)-5-(thiophen-2-ylmethylidene)piperidin-1-ium-4-one

Systemtic Name: (3Z,5E)-3-(phenylmethylidene)-1-(thiophen-2-ylmethyl)-5-(thiophen-2-ylmethylidene)piperidin-1-ium-4-one Openeye Name: (3Z,5E)-3-benzylidene-1-(2-thienylmethyl)-5-(2-thienylmethylene)piperidin-1-ium-4-one CAS Name: (3Z,5E)-3-(phenylmethylene)-1-(thiophen-2-ylmethyl)-5-(thiophen-2-ylmethylidene)-4-piperidin-1-iumone IUPAC Name: (3Z,5E)-3-benzylidene-1-(thiophen-2-ylmethyl)-5-(thiophen-2-ylmethylidene)piperidin-1-ium-4-one Traditional Name: (3Z,5E)-3-benzal-1-(2-thenyl)-5-(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=CC=C2)C(=O)C(=CC3=CC=CS3)C[NH+]1CC4=CC=CS4

Isomeric SMILES

C1/C(=C/C2=CC=CC=C2)/C(=O)/C(=C/C3=CC=CS3)/C[NH+]1CC4=CC=CS4

InChI

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