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

Systemtic Name: 1-(2-bromophenyl)-5-propan-2-yl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(2-bromophenyl)-5-isopropyl-triazole-4-carboxylic acid CAS Name: 1-(2-bromophenyl)-5-propan-2-yl-4-triazolecarboxylic acid IUPAC Name: 1-(2-bromophenyl)-5-propan-2-yltriazole-4-carboxylic acid Traditional Name: 1-(2-bromophenyl)-5-isopropyl-triazole-4-carboxylic acid Formula: C12H12BrN3O2 MolecularWeight: 310.14658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=NN1C2=CC=CC=C2Br)C(=O)O

Isomeric SMILES

CC(C)C1=C(N=NN1C2=CC=CC=C2Br)C(=O)O

InChI

InChI=1S/C12H12BrN3O2/c1-7(2)11-10(12(17)18)14-15-16(11)9-6-4-3-5-8(9)13/h3-7H,1-2H3,(H,17,18)