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

Systemtic Name: 2-(5-bromanyl-1,3-benzothiazol-2-yl)ethanoic acid Openeye Name: 2-(5-bromo-1,3-benzothiazol-2-yl)acetic acid CAS Name: 2-(5-bromo-1,3-benzothiazol-2-yl)acetic acid IUPAC Name: 2-(5-bromo-1,3-benzothiazol-2-yl)acetic acid Traditional Name: 2-(5-bromo-1,3-benzothiazol-2-yl)acetic acid Formula: C9H6BrNO2S MolecularWeight: 272.11844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H6BrNO2S/c10-5-1-2-7-6(3-5)11-8(14-7)4-9(12)13/h1-3H,4H2,(H,12,13)