2-(2,4-dinitrophenyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 2-(2,4-dinitrophenyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 2-(2,4-dinitrophenyl)triazole-4-carboxylic acid CAS Name: 2-(2,4-dinitrophenyl)-4-triazolecarboxylic acid IUPAC Name: 2-(2,4-dinitrophenyl)triazole-4-carboxylic acid Traditional Name: 2-(2,4-dinitrophenyl)triazole-4-carboxylic acid Formula: C9H5N5O6 MolecularWeight: 279.1659

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N2N=CC(=N2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])N2N=CC(=N2)C(=O)O

InChI

InChI=1S/C9H5N5O6/c15-9(16)6-4-10-12(11-6)7-2-1-5(13(17)18)3-8(7)14(19)20/h1-4H,(H,15,16)