3-prop-1-en-2-yl-1,3-benzothiazol-3-ium perchlorate

Systemtic Name: 3-prop-1-en-2-yl-1,3-benzothiazol-3-ium perchlorate Openeye Name: 3-isopropenyl-1,3-benzothiazol-3-ium perchlorate CAS Name: 3-(1-methylethenyl)-1,3-benzothiazol-3-ium perchlorate IUPAC Name: 3-prop-1-en-2-yl-1,3-benzothiazol-3-ium perchlorate Traditional Name: 3-isopropenyl-1,3-benzothiazol-3-ium perchlorate Formula: C10H10ClNO4S MolecularWeight: 275.7087

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)[N+]1=CSC2=CC=CC=C21.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(=C)[N+]1=CSC2=CC=CC=C21.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C10H10NS.ClHO4/c1-8(2)11-7-12-10-6-4-3-5-9(10)11;2-1(3,4)5/h3-7H,1H2,2H3;(H,2,3,4,5)/q+1;/p-1