benzotriazol-1-yl-(5-bromanyl-2-oxidanyl-phenyl)methanone

Systemtic Name: benzotriazol-1-yl-(5-bromanyl-2-oxidanyl-phenyl)methanone Openeye Name: benzotriazol-1-yl-(5-bromo-2-hydroxy-phenyl)methanone CAS Name: 1-benzotriazolyl-(5-bromo-2-hydroxyphenyl)methanone IUPAC Name: benzotriazol-1-yl-(5-bromo-2-hydroxyphenyl)methanone Traditional Name: benzotriazol-1-yl-(5-bromo-2-hydroxy-phenyl)methanone Formula: C13H8BrN3O2 MolecularWeight: 318.12552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(=O)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C(=O)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C13H8BrN3O2/c14-8-5-6-12(18)9(7-8)13(19)17-11-4-2-1-3-10(11)15-16-17/h1-7,18H