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

Systemtic Name: 4,5-dimethyl-2-(4-nitrophenyl)-1,2-thiazol-2-ium perchlorate Openeye Name: 4,5-dimethyl-2-(4-nitrophenyl)isothiazol-2-ium perchlorate CAS Name: 4,5-dimethyl-2-(4-nitrophenyl)isothiazol-2-ium perchlorate IUPAC Name: 4,5-dimethyl-2-(4-nitrophenyl)-1,2-thiazol-2-ium perchlorate Traditional Name: 4,5-dimethyl-2-(4-nitrophenyl)isothiazol-2-ium perchlorate Formula: C11H11ClN2O6S MolecularWeight: 334.73284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(S[N+](=C1)C2=CC=C(C=C2)[N+](=O)[O-])C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=C(S[N+](=C1)C2=CC=C(C=C2)[N+](=O)[O-])C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C11H11N2O2S.ClHO4/c1-8-7-12(16-9(8)2)10-3-5-11(6-4-10)13(14)15;2-1(3,4)5/h3-7H,1-2H3;(H,2,3,4,5)/q+1;/p-1