5-bromanyl-2-(1,2,4-triazol-4-yl)benzoate

Systemtic Name: 5-bromanyl-2-(1,2,4-triazol-4-yl)benzoate Openeye Name: 5-bromo-2-(1,2,4-triazol-4-yl)benzoate CAS Name: 5-bromo-2-(1,2,4-triazol-4-yl)benzoate IUPAC Name: 5-bromo-2-(1,2,4-triazol-4-yl)benzoate Traditional Name: 5-bromo-2-(1,2,4-triazol-4-yl)benzoate Formula: C9H5BrN3O2- MolecularWeight: 267.0589

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C(=O)[O-])N2C=NN=C2

Isomeric SMILES

C1=CC(=C(C=C1Br)C(=O)[O-])N2C=NN=C2

InChI

InChI=1S/C9H6BrN3O2/c10-6-1-2-8(7(3-6)9(14)15)13-4-11-12-5-13/h1-5H,(H,14,15)/p-1