5-cyclopropyl-1-[2,4,6-tris(bromanyl)phenyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-cyclopropyl-1-[2,4,6-tris(bromanyl)phenyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-cyclopropyl-1-(2,4,6-tribromophenyl)triazole-4-carboxylic acid CAS Name: 5-cyclopropyl-1-(2,4,6-tribromophenyl)-4-triazolecarboxylic acid IUPAC Name: 5-cyclopropyl-1-(2,4,6-tribromophenyl)triazole-4-carboxylic acid Traditional Name: 5-cyclopropyl-1-(2,4,6-tribromophenyl)triazole-4-carboxylic acid Formula: C12H8Br3N3O2 MolecularWeight: 465.92282

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(N=NN2C3=C(C=C(C=C3Br)Br)Br)C(=O)O

Isomeric SMILES

C1CC1C2=C(N=NN2C3=C(C=C(C=C3Br)Br)Br)C(=O)O

InChI

InChI=1S/C12H8Br3N3O2/c13-6-3-7(14)11(8(15)4-6)18-10(5-1-2-5)9(12(19)20)16-17-18/h3-5H,1-2H2,(H,19,20)