3-(2-hydroxyethyl)-6-nitro-benzotriazole-4-carboxylic acid

Systemtic Name: 3-(2-hydroxyethyl)-6-nitro-benzotriazole-4-carboxylic acid Openeye Name: 3-(2-hydroxyethyl)-6-nitro-benzotriazole-4-carboxylic acid CAS Name: 3-(2-hydroxyethyl)-6-nitro-4-benzotriazolecarboxylic acid IUPAC Name: 3-(2-hydroxyethyl)-6-nitrobenzotriazole-4-carboxylic acid Traditional Name: 3-(2-hydroxyethyl)-6-nitro-benzotriazole-4-carboxylic acid Formula: C9H8N4O5 MolecularWeight: 252.18362

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=C1N=NN2CCO)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C2=C1N=NN2CCO)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C9H8N4O5/c14-2-1-12-8-6(9(15)16)3-5(13(17)18)4-7(8)10-11-12/h3-4,14H,1-2H2,(H,15,16)