(Z)-1-thianthren-5-ium-5-ylpent-1-en-2-olate

Systemtic Name: (Z)-1-thianthren-5-ium-5-ylpent-1-en-2-olate Openeye Name: (Z)-1-thianthren-5-ium-5-ylpent-1-en-2-olate CAS Name: (Z)-1-(5-thianthren-5-iumyl)-1-penten-2-olate IUPAC Name: (Z)-1-thianthren-5-ium-5-ylpent-1-en-2-olate Traditional Name: (Z)-1-thianthren-5-ium-5-ylpent-1-en-2-olate Formula: C17H16OS2 MolecularWeight: 300.43834

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C[S+]1C2=CC=CC=C2SC3=CC=CC=C31)[O-]

Isomeric SMILES

CCC/C(=C/[S+]1C2=CC=CC=C2SC3=CC=CC=C31)/[O-]

InChI

InChI=1S/C17H16OS2/c1-2-7-13(18)12-20-16-10-5-3-8-14(16)19-15-9-4-6-11-17(15)20/h3-6,8-12H,2,7H2,1H3/b13-12-