2-(4-chlorophenyl)-5-(4-methylphenyl)-1,2-thiazol-2-ium perchlorate

Systemtic Name: 2-(4-chlorophenyl)-5-(4-methylphenyl)-1,2-thiazol-2-ium perchlorate Openeye Name: 2-(4-chlorophenyl)-5-(p-tolyl)isothiazol-2-ium perchlorate CAS Name: 2-(4-chlorophenyl)-5-(4-methylphenyl)isothiazol-2-ium perchlorate IUPAC Name: 2-(4-chlorophenyl)-5-(4-methylphenyl)-1,2-thiazol-2-ium perchlorate Traditional Name: 2-(4-chlorophenyl)-5-(p-tolyl)isothiazol-2-ium perchlorate Formula: C16H13Cl2NO4S MolecularWeight: 386.24972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=[N+](S2)C3=CC=C(C=C3)Cl.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=[N+](S2)C3=CC=C(C=C3)Cl.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C16H13ClNS.ClHO4/c1-12-2-4-13(5-3-12)16-10-11-18(19-16)15-8-6-14(17)7-9-15;2-1(3,4)5/h2-11H,1H3;(H,2,3,4,5)/q+1;/p-1