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

Systemtic Name: 1-(3-bromophenyl)-5-propan-2-yl-1,2,3-triazole-4-carboxylate Openeye Name: 1-(3-bromophenyl)-5-isopropyl-triazole-4-carboxylate CAS Name: 1-(3-bromophenyl)-5-propan-2-yl-4-triazolecarboxylate IUPAC Name: 1-(3-bromophenyl)-5-propan-2-yltriazole-4-carboxylate Traditional Name: 1-(3-bromophenyl)-5-isopropyl-triazole-4-carboxylate Formula: C12H11BrN3O2- MolecularWeight: 309.13864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=NN1C2=CC(=CC=C2)Br)C(=O)[O-]

Isomeric SMILES

CC(C)C1=C(N=NN1C2=CC(=CC=C2)Br)C(=O)[O-]

InChI

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