2-(5-bromanyl-1,3-benzothiazol-2-yl)cyclohexane-1-carboxylic acid

Systemtic Name: 2-(5-bromanyl-1,3-benzothiazol-2-yl)cyclohexane-1-carboxylic acid Openeye Name: 2-(5-bromo-1,3-benzothiazol-2-yl)cyclohexanecarboxylic acid CAS Name: 2-(5-bromo-1,3-benzothiazol-2-yl)-1-cyclohexanecarboxylic acid IUPAC Name: 2-(5-bromo-1,3-benzothiazol-2-yl)cyclohexane-1-carboxylic acid Traditional Name: 2-(5-bromo-1,3-benzothiazol-2-yl)cyclohexanecarboxylic acid Formula: C14H14BrNO2S MolecularWeight: 340.23546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=NC3=C(S2)C=CC(=C3)Br)C(=O)O

Isomeric SMILES

C1CCC(C(C1)C2=NC3=C(S2)C=CC(=C3)Br)C(=O)O

InChI

InChI=1S/C14H14BrNO2S/c15-8-5-6-12-11(7-8)16-13(19-12)9-3-1-2-4-10(9)14(17)18/h5-7,9-10H,1-4H2,(H,17,18)