5-(5-methyl-1,3-benzothiazol-2-yl)pentanoic acid

Systemtic Name: 5-(5-methyl-1,3-benzothiazol-2-yl)pentanoic acid Openeye Name: 5-(5-methyl-1,3-benzothiazol-2-yl)pentanoic acid CAS Name: 5-(5-methyl-1,3-benzothiazol-2-yl)pentanoic acid IUPAC Name: 5-(5-methyl-1,3-benzothiazol-2-yl)pentanoic acid Traditional Name: 5-(5-methyl-1,3-benzothiazol-2-yl)valeric acid Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC(=N2)CCCCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)SC(=N2)CCCCC(=O)O

InChI

InChI=1S/C13H15NO2S/c1-9-6-7-11-10(8-9)14-12(17-11)4-2-3-5-13(15)16/h6-8H,2-5H2,1H3,(H,15,16)