2,5-dimethyl-3-(4-nitrophenyl)-1,3-thiazol-3-ium bromide

Systemtic Name: 2,5-dimethyl-3-(4-nitrophenyl)-1,3-thiazol-3-ium bromide Openeye Name: 2,5-dimethyl-3-(4-nitrophenyl)thiazol-3-ium bromide CAS Name: 2,5-dimethyl-3-(4-nitrophenyl)thiazol-3-ium bromide IUPAC Name: 2,5-dimethyl-3-(4-nitrophenyl)-1,3-thiazol-3-ium bromide Traditional Name: 2,5-dimethyl-3-(4-nitrophenyl)thiazol-3-ium bromide Formula: C11H11BrN2O2S MolecularWeight: 315.18624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=C(S1)C)C2=CC=C(C=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

CC1=C[N+](=C(S1)C)C2=CC=C(C=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C11H11N2O2S.BrH/c1-8-7-12(9(2)16-8)10-3-5-11(6-4-10)13(14)15;/h3-7H,1-2H3;1H/q+1;/p-1