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

Systemtic Name: 5-(5-chloranyl-1,3-benzothiazol-2-yl)pentanoic acid Openeye Name: 5-(5-chloro-1,3-benzothiazol-2-yl)pentanoic acid CAS Name: 5-(5-chloro-1,3-benzothiazol-2-yl)pentanoic acid IUPAC Name: 5-(5-chloro-1,3-benzothiazol-2-yl)pentanoic acid Traditional Name: 5-(5-chloro-1,3-benzothiazol-2-yl)valeric acid Formula: C12H12ClNO2S MolecularWeight: 269.74718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(S2)CCCCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(S2)CCCCC(=O)O

InChI

InChI=1S/C12H12ClNO2S/c13-8-5-6-10-9(7-8)14-11(17-10)3-1-2-4-12(15)16/h5-7H,1-4H2,(H,15,16)