4-(5-chloranyl-1,3-benzothiazol-2-yl)butanoate

Systemtic Name: 4-(5-chloranyl-1,3-benzothiazol-2-yl)butanoate Openeye Name: 4-(5-chloro-1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(5-chloro-1,3-benzothiazol-2-yl)butanoate IUPAC Name: 4-(5-chloro-1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(5-chloro-1,3-benzothiazol-2-yl)butyrate Formula: C11H9ClNO2S- MolecularWeight: 254.71266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(S2)CCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(S2)CCCC(=O)[O-]

InChI

InChI=1S/C11H10ClNO2S/c12-7-4-5-9-8(6-7)13-10(16-9)2-1-3-11(14)15/h4-6H,1-3H2,(H,14,15)/p-1