1-(2-bromanyl-4-nitro-phenyl)-5-methyl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(2-bromanyl-4-nitro-phenyl)-5-methyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(2-bromo-4-nitro-phenyl)-5-methyl-triazole-4-carboxylic acid CAS Name: 1-(2-bromo-4-nitrophenyl)-5-methyl-4-triazolecarboxylic acid IUPAC Name: 1-(2-bromo-4-nitrophenyl)-5-methyltriazole-4-carboxylic acid Traditional Name: 1-(2-bromo-4-nitro-phenyl)-5-methyl-triazole-4-carboxylic acid Formula: C10H7BrN4O4 MolecularWeight: 327.09098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=C(C=C(C=C2)[N+](=O)[O-])Br)C(=O)O

Isomeric SMILES

CC1=C(N=NN1C2=C(C=C(C=C2)[N+](=O)[O-])Br)C(=O)O

InChI

InChI=1S/C10H7BrN4O4/c1-5-9(10(16)17)12-13-14(5)8-3-2-6(15(18)19)4-7(8)11/h2-4H,1H3,(H,16,17)