1-(4-chloranyl-3-nitro-phenyl)-5-cyclopropyl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)-5-cyclopropyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(4-chloro-3-nitro-phenyl)-5-cyclopropyl-triazole-4-carboxylic acid CAS Name: 1-(4-chloro-3-nitrophenyl)-5-cyclopropyl-4-triazolecarboxylic acid IUPAC Name: 1-(4-chloro-3-nitrophenyl)-5-cyclopropyltriazole-4-carboxylic acid Traditional Name: 1-(4-chloro-3-nitro-phenyl)-5-cyclopropyl-triazole-4-carboxylic acid Formula: C12H9ClN4O4 MolecularWeight: 308.67726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9ClN4O4/c13-8-4-3-7(5-9(8)17(20)21)16-11(6-1-2-6)10(12(18)19)14-15-16/h3-6H,1-2H2,(H,18,19)