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2-[2-(4-methoxyphenyl)ethynyl]-3-methyl-1,3-benzothiazol-3-ium

2-[2-(4-methoxyphenyl)ethynyl]-3-methyl-1,3-benzothiazol-3-ium

Systemtic Name:2-[2-(4-methoxyphenyl)ethynyl]-3-methyl-1,3-benzothiazol-3-ium
Openeye Name:2-[2-(4-methoxyphenyl)ethynyl]-3-methyl-1,3-benzothiazol-3-ium
CAS Name:2-[2-(4-methoxyphenyl)ethynyl]-3-methyl-1,3-benzothiazol-3-ium
IUPAC Name:2-[2-(4-methoxyphenyl)ethynyl]-3-methyl-1,3-benzothiazol-3-ium
Traditional Name:2-[2-(4-methoxyphenyl)ethynyl]-3-methyl-1,3-benzothiazol-3-ium
Formula: C17H14NOS+
MolecularWeight: 280.36416
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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=CC=CC=C21)C#CC3=CC=C(C=C3)OC


Isomeric SMILES

C[N+]1=C(SC2=CC=CC=C21)C#CC3=CC=C(C=C3)OC


InChI

InChI=1S/C17H14NOS/c1-18-15-5-3-4-6-16(15)20-17(18)12-9-13-7-10-14(19-2)11-8-13/h3-8,10-11H,1-2H3/q+1


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