3-(4-bromanyl-6-chloranyl-benzotriazol-2-yl)-4-oxidanyl-benzoic acid

Systemtic Name: 3-(4-bromanyl-6-chloranyl-benzotriazol-2-yl)-4-oxidanyl-benzoic acid Openeye Name: 3-(4-bromo-6-chloro-benzotriazol-2-yl)-4-hydroxy-benzoic acid CAS Name: 3-(4-bromo-6-chloro-2-benzotriazolyl)-4-hydroxybenzoic acid IUPAC Name: 3-(4-bromo-6-chlorobenzotriazol-2-yl)-4-hydroxybenzoic acid Traditional Name: 3-(4-bromo-6-chloro-benzotriazol-2-yl)-4-hydroxy-benzoic acid Formula: C13H7BrClN3O3 MolecularWeight: 368.56998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)N2N=C3C=C(C=C(C3=N2)Br)Cl)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)N2N=C3C=C(C=C(C3=N2)Br)Cl)O

InChI

InChI=1S/C13H7BrClN3O3/c14-8-4-7(15)5-9-12(8)17-18(16-9)10-3-6(13(20)21)1-2-11(10)19/h1-5,19H,(H,20,21)