[4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-dimethyl-azanium

Systemtic Name: [4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-dimethyl-azanium Openeye Name: [4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-dimethyl-ammonium CAS Name: [4-(2,6-ditert-butyl-4-thiopyranylidene)-1-cyclohexa-2,5-dienylidene]-dimethylammonium IUPAC Name: [4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-dimethylazanium Traditional Name: [4-(2,6-ditert-butylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]-dimethyl-ammonium Formula: C21H30NS+ MolecularWeight: 328.5346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C=CC(=[N+](C)C)C=C2)C=C(S1)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C=CC(=[N+](C)C)C=C2)C=C(S1)C(C)(C)C

InChI

InChI=1S/C21H30NS/c1-20(2,3)18-13-16(14-19(23-18)21(4,5)6)15-9-11-17(12-10-15)22(7)8/h9-14H,1-8H3/q+1