1-(3-bromophenyl)-5-[(2R)-oxolan-2-yl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-(3-bromophenyl)-5-[(2R)-oxolan-2-yl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-(3-bromophenyl)-5-[(2R)-tetrahydrofuran-2-yl]triazole-4-carboxylate CAS Name: 1-(3-bromophenyl)-5-[(2R)-2-oxolanyl]-4-triazolecarboxylate IUPAC Name: 1-(3-bromophenyl)-5-[(2R)-oxolan-2-yl]triazole-4-carboxylate Traditional Name: 1-(3-bromophenyl)-5-[(2R)-tetrahydrofuran-2-yl]triazole-4-carboxylate Formula: C13H11BrN3O3- MolecularWeight: 337.14874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C2=C(N=NN2C3=CC(=CC=C3)Br)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](OC1)C2=C(N=NN2C3=CC(=CC=C3)Br)C(=O)[O-]

InChI

InChI=1S/C13H12BrN3O3/c14-8-3-1-4-9(7-8)17-12(10-5-2-6-20-10)11(13(18)19)15-16-17/h1,3-4,7,10H,2,5-6H2,(H,18,19)/p-1/t10-/m1/s1