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

Systemtic Name: 2-(4-nitrophenyl)-4,5-diphenyl-1,2-thiazol-2-ium perchlorate Openeye Name: 2-(4-nitrophenyl)-4,5-diphenyl-isothiazol-2-ium perchlorate CAS Name: 2-(4-nitrophenyl)-4,5-diphenylisothiazol-2-ium perchlorate IUPAC Name: 2-(4-nitrophenyl)-4,5-diphenyl-1,2-thiazol-2-ium perchlorate Traditional Name: 2-(4-nitrophenyl)-4,5-diphenyl-isothiazol-2-ium perchlorate Formula: C21H15ClN2O6S MolecularWeight: 458.8716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(S[N+](=C2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(S[N+](=C2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H15N2O2S.ClHO4/c24-23(25)19-13-11-18(12-14-19)22-15-20(16-7-3-1-4-8-16)21(26-22)17-9-5-2-6-10-17;2-1(3,4)5/h1-15H;(H,2,3,4,5)/q+1;/p-1