trimethyl-[4-[oxidanyl(dithiophen-2-yl)methyl]cyclohexyl]azanium bromide

Systemtic Name: trimethyl-[4-[oxidanyl(dithiophen-2-yl)methyl]cyclohexyl]azanium bromide Openeye Name: [4-[hydroxy-bis(2-thienyl)methyl]cyclohexyl]-trimethyl-ammonium bromide CAS Name: [4-[hydroxy(dithiophen-2-yl)methyl]cyclohexyl]-trimethylammonium bromide IUPAC Name: [4-[hydroxy(dithiophen-2-yl)methyl]cyclohexyl]-trimethylazanium bromide Traditional Name: [4-[hydroxy-bis(2-thienyl)methyl]cyclohexyl]-trimethyl-ammonium bromide Formula: C18H26BrNOS2 MolecularWeight: 416.43914

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1CCC(CC1)C(C2=CC=CS2)(C3=CC=CS3)O.[Br-]

Isomeric SMILES

C[N+](C)(C)C1CCC(CC1)C(C2=CC=CS2)(C3=CC=CS3)O.[Br-]

InChI

InChI=1S/C18H26NOS2.BrH/c1-19(2,3)15-10-8-14(9-11-15)18(20,16-6-4-12-21-16)17-7-5-13-22-17;/h4-7,12-15,20H,8-11H2,1-3H3;1H/q+1;/p-1