3-[4-[3-(4-fluoranylphenoxy)propyl]piperazin-4-ium-1-yl]-1,2-benzothiazole

Systemtic Name: 3-[4-[3-(4-fluoranylphenoxy)propyl]piperazin-4-ium-1-yl]-1,2-benzothiazole Openeye Name: 3-[4-[3-(4-fluorophenoxy)propyl]piperazin-4-ium-1-yl]-1,2-benzothiazole CAS Name: 3-[4-[3-(4-fluorophenoxy)propyl]-1-piperazin-4-iumyl]-1,2-benzothiazole IUPAC Name: 3-[4-[3-(4-fluorophenoxy)propyl]piperazin-4-ium-1-yl]-1,2-benzothiazole Traditional Name: 3-[4-[3-(4-fluorophenoxy)propyl]piperazin-4-ium-1-yl]-1,2-benzothiazole Formula: C20H23FN3OS+ MolecularWeight: 372.479523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCOC2=CC=C(C=C2)F)C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CCCOC2=CC=C(C=C2)F)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C20H22FN3OS/c21-16-6-8-17(9-7-16)25-15-3-10-23-11-13-24(14-12-23)20-18-4-1-2-5-19(18)26-22-20/h1-2,4-9H,3,10-15H2/p+1