1-(4-bromophenyl)-5-(furan-2-yl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(4-bromophenyl)-5-(furan-2-yl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(4-bromophenyl)-5-(2-furyl)triazole-4-carboxylic acid CAS Name: 1-(4-bromophenyl)-5-(2-furanyl)-4-triazolecarboxylic acid IUPAC Name: 1-(4-bromophenyl)-5-(furan-2-yl)triazole-4-carboxylic acid Traditional Name: 1-(4-bromophenyl)-5-(2-furyl)triazole-4-carboxylic acid Formula: C13H8BrN3O3 MolecularWeight: 334.12492

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C(N=NN2C3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1=COC(=C1)C2=C(N=NN2C3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C13H8BrN3O3/c14-8-3-5-9(6-4-8)17-12(10-2-1-7-20-10)11(13(18)19)15-16-17/h1-7H,(H,18,19)