1-(2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-2-ol perchlorate

Systemtic Name: 1-(2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-2-ol perchlorate Openeye Name: 1-(2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-2-ol perchlorate CAS Name: 1-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-2-propanol perchlorate IUPAC Name: 1-(2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-2-ol perchlorate Traditional Name: 1-(2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-2-ol perchlorate Formula: C11H14ClNO5S MolecularWeight: 307.75056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2S1)CC(C)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2S1)CC(C)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C11H14NOS.ClHO4/c1-8(13)7-12-9(2)14-11-6-4-3-5-10(11)12;2-1(3,4)5/h3-6,8,13H,7H2,1-2H3;(H,2,3,4,5)/q+1;/p-1