1,1,2,3-tetramethyl-5-(trifluoromethylsulfonyl)benzo[e]indol-3-ium iodide

Systemtic Name: 1,1,2,3-tetramethyl-5-(trifluoromethylsulfonyl)benzo[e]indol-3-ium iodide Openeye Name: 1,1,2,3-tetramethyl-5-(trifluoromethylsulfonyl)benzo[e]indol-3-ium iodide CAS Name: 1,1,2,3-tetramethyl-5-(trifluoromethylsulfonyl)benzo[e]indol-3-ium iodide IUPAC Name: 1,1,2,3-tetramethyl-5-(trifluoromethylsulfonyl)benzo[e]indol-3-ium iodide Traditional Name: 1,1,2,3-tetramethyl-5-triflyl-benz[e]indol-3-ium iodide Formula: C17H17F3INO2S MolecularWeight: 483.28706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(C1(C)C)C3=CC=CC=C3C(=C2)S(=O)(=O)C(F)(F)F)C.[I-]

Isomeric SMILES

CC1=[N+](C2=C(C1(C)C)C3=CC=CC=C3C(=C2)S(=O)(=O)C(F)(F)F)C.[I-]

InChI

InChI=1S/C17H17F3NO2S.HI/c1-10-16(2,3)15-12-8-6-5-7-11(12)14(9-13(15)21(10)4)24(22,23)17(18,19)20;/h5-9H,1-4H3;1H/q+1;/p-1