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3-(5-methoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-1-ol

3-(5-methoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-1-ol

Systemtic Name:3-(5-methoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-1-ol
Openeye Name:3-(5-methoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-1-ol
CAS Name:3-(5-methoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)-1-propanol
IUPAC Name:3-(5-methoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-1-ol
Traditional Name:3-(5-methoxy-2-methyl-1,3-benzothiazol-3-ium-3-yl)propan-1-ol
Formula: C12H16NO2S+
MolecularWeight: 238.32594
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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(S1)C=CC(=C2)OC)CCCO


Isomeric SMILES

CC1=[N+](C2=C(S1)C=CC(=C2)OC)CCCO


InChI

InChI=1S/C12H16NO2S/c1-9-13(6-3-7-14)11-8-10(15-2)4-5-12(11)16-9/h4-5,8,14H,3,6-7H2,1-2H3/q+1


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