3-methyl-2-propan-2-yl-1,3-benzothiazol-3-ium perchlorate

Systemtic Name: 3-methyl-2-propan-2-yl-1,3-benzothiazol-3-ium perchlorate Openeye Name: 2-isopropyl-3-methyl-1,3-benzothiazol-3-ium perchlorate CAS Name: 3-methyl-2-propan-2-yl-1,3-benzothiazol-3-ium perchlorate IUPAC Name: 3-methyl-2-propan-2-yl-1,3-benzothiazol-3-ium perchlorate Traditional Name: 2-isopropyl-3-methyl-1,3-benzothiazol-3-ium perchlorate Formula: C11H14ClNO4S MolecularWeight: 291.75116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=[N+](C2=CC=CC=C2S1)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(C)C1=[N+](C2=CC=CC=C2S1)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C11H14NS.ClHO4/c1-8(2)11-12(3)9-6-4-5-7-10(9)13-11;2-1(3,4)5/h4-8H,1-3H3;(H,2,3,4,5)/q+1;/p-1