[4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-methyl-oxidanium iodide

Systemtic Name: [4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-methyl-oxidanium iodide Openeye Name: [4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-methyl-oxonium iodide CAS Name: [4-(2,6-ditert-butyl-4-thiopyranylidene)-1-cyclohexa-2,5-dienylidene]-methyloxonium iodide IUPAC Name: [4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-methyloxidanium iodide Traditional Name: [4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-methyl-oxonium iodide Formula: C20H27IOS MolecularWeight: 442.39725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C=CC(=[O+]C)C=C2)C=C(S1)C(C)(C)C.[I-]

Isomeric SMILES

CC(C)(C)C1=CC(=C2C=CC(=[O+]C)C=C2)C=C(S1)C(C)(C)C.[I-]

InChI

InChI=1S/C20H27OS.HI/c1-19(2,3)17-12-15(13-18(22-17)20(4,5)6)14-8-10-16(21-7)11-9-14;/h8-13H,1-7H3;1H/q+1;/p-1