5-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pentanoic acid

Systemtic Name: 5-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pentanoic acid Openeye Name: 5-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pentanoic acid CAS Name: 5-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pentanoic acid IUPAC Name: 5-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pentanoic acid Traditional Name: 5-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]valeric acid Formula: C13H12F3NO2S MolecularWeight: 303.30009

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)N=C(S2)CCCCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)N=C(S2)CCCCC(=O)O

InChI

InChI=1S/C13H12F3NO2S/c14-13(15,16)8-5-6-10-9(7-8)17-11(20-10)3-1-2-4-12(18)19/h5-7H,1-4H2,(H,18,19)