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4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)butan-2-ol

4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)butan-2-ol

Systemtic Name:4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)butan-2-ol
Openeye Name:4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)butan-2-ol
CAS Name:4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)-2-butanol
IUPAC Name:4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)butan-2-ol
Traditional Name:4-(3-methyl-1,3-benzothiazol-3-ium-2-yl)butan-2-ol
Formula: C12H16NOS+
MolecularWeight: 222.32654
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=[N+](C2=CC=CC=C2S1)C)O


Isomeric SMILES

CC(CCC1=[N+](C2=CC=CC=C2S1)C)O


InChI

InChI=1S/C12H16NOS/c1-9(14)7-8-12-13(2)10-5-3-4-6-11(10)15-12/h3-6,9,14H,7-8H2,1-2H3/q+1


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