(4E)-3-oxidanyl-4-(5-pyrrolidin-1-ium-1-ylidenethiophen-2-ylidene)-2-(5-pyrrolidin-1-ylthiophen-2-yl)cyclobut-2-en-1-one

Systemtic Name: (4E)-3-oxidanyl-4-(5-pyrrolidin-1-ium-1-ylidenethiophen-2-ylidene)-2-(5-pyrrolidin-1-ylthiophen-2-yl)cyclobut-2-en-1-one Openeye Name: (4E)-3-hydroxy-4-(5-pyrrolidin-1-ium-1-ylidene-2-thienylidene)-2-(5-pyrrolidin-1-yl-2-thienyl)cyclobut-2-en-1-one CAS Name: (4E)-3-hydroxy-4-[5-(1-pyrrolidin-1-iumylidene)-2-thiophenylidene]-2-[5-(1-pyrrolidinyl)-2-thiophenyl]-1-cyclobut-2-enone IUPAC Name: (4E)-3-hydroxy-4-(5-pyrrolidin-1-ium-1-ylidenethiophen-2-ylidene)-2-(5-pyrrolidin-1-ylthiophen-2-yl)cyclobut-2-en-1-one Traditional Name: (4E)-3-hydroxy-4-(5-pyrrolidin-1-ium-1-ylidene-2-thienylidene)-2-(5-pyrrolidino-2-thienyl)cyclobut-2-en-1-one Formula: C20H21N2O2S2+ MolecularWeight: 385.52294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(S2)C3=C(C(=C4C=CC(=[N+]5CCCC5)S4)C3=O)O

Isomeric SMILES

C1CCN(C1)C2=CC=C(S2)C3=C(/C(=C\4/C=CC(=[N+]5CCCC5)S4)/C3=O)O

InChI

InChI=1S/C20H20N2O2S2/c23-19-17(13-5-7-15(25-13)21-9-1-2-10-21)20(24)18(19)14-6-8-16(26-14)22-11-3-4-12-22/h5-8H,1-4,9-12H2/p+1