3-[bis(5-chloranylthiophen-2-yl)methylidene]-1-azoniabicyclo[2.2.2]octane

Systemtic Name: 3-[bis(5-chloranylthiophen-2-yl)methylidene]-1-azoniabicyclo[2.2.2]octane Openeye Name: 3-[bis(5-chloro-2-thienyl)methylene]quinuclidin-1-ium CAS Name: 3-[bis(5-chloro-2-thiophenyl)methylidene]-1-azoniabicyclo[2.2.2]octane IUPAC Name: 3-[bis(5-chlorothiophen-2-yl)methylidene]-1-azoniabicyclo[2.2.2]octane Traditional Name: 3-[bis(5-chloro-2-thienyl)methylene]quinuclidin-1-ium Formula: C16H16Cl2NS2+ MolecularWeight: 357.34094

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(=C(C3=CC=C(S3)Cl)C4=CC=C(S4)Cl)C2

Isomeric SMILES

C1C[NH+]2CCC1C(=C(C3=CC=C(S3)Cl)C4=CC=C(S4)Cl)C2

InChI

InChI=1S/C16H15Cl2NS2/c17-14-3-1-12(20-14)16(13-2-4-15(18)21-13)11-9-19-7-5-10(11)6-8-19/h1-4,10H,5-9H2/p+1