4-(5-bromanyl-1,3-benzothiazol-2-yl)butanoic acid

Systemtic Name: 4-(5-bromanyl-1,3-benzothiazol-2-yl)butanoic acid Openeye Name: 4-(5-bromo-1,3-benzothiazol-2-yl)butanoic acid CAS Name: 4-(5-bromo-1,3-benzothiazol-2-yl)butanoic acid IUPAC Name: 4-(5-bromo-1,3-benzothiazol-2-yl)butanoic acid Traditional Name: 4-(5-bromo-1,3-benzothiazol-2-yl)butyric acid Formula: C11H10BrNO2S MolecularWeight: 300.1716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)N=C(S2)CCCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Br)N=C(S2)CCCC(=O)O

InChI

InChI=1S/C11H10BrNO2S/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)