1-(3-bromophenyl)-5-cyclopropyl-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-(3-bromophenyl)-5-cyclopropyl-1,2,3-triazole-4-carboxylate Openeye Name: 1-(3-bromophenyl)-5-cyclopropyl-triazole-4-carboxylate CAS Name: 1-(3-bromophenyl)-5-cyclopropyl-4-triazolecarboxylate IUPAC Name: 1-(3-bromophenyl)-5-cyclopropyltriazole-4-carboxylate Traditional Name: 1-(3-bromophenyl)-5-cyclopropyl-triazole-4-carboxylate Formula: C12H9BrN3O2- MolecularWeight: 307.12276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(N=NN2C3=CC(=CC=C3)Br)C(=O)[O-]

Isomeric SMILES

C1CC1C2=C(N=NN2C3=CC(=CC=C3)Br)C(=O)[O-]

InChI

InChI=1S/C12H10BrN3O2/c13-8-2-1-3-9(6-8)16-11(7-4-5-7)10(12(17)18)14-15-16/h1-3,6-7H,4-5H2,(H,17,18)/p-1