4-(2-hydroxyethyl)-1-(2-nitrophenyl)pyrazole-3-carboxylic acid

Systemtic Name: 4-(2-hydroxyethyl)-1-(2-nitrophenyl)pyrazole-3-carboxylic acid Openeye Name: 4-(2-hydroxyethyl)-1-(2-nitrophenyl)pyrazole-3-carboxylic acid CAS Name: 4-(2-hydroxyethyl)-1-(2-nitrophenyl)-3-pyrazolecarboxylic acid IUPAC Name: 4-(2-hydroxyethyl)-1-(2-nitrophenyl)pyrazole-3-carboxylic acid Traditional Name: 4-(2-hydroxyethyl)-1-(2-nitrophenyl)pyrazole-3-carboxylic acid Formula: C12H11N3O5 MolecularWeight: 277.23284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N2C=C(C(=N2)C(=O)O)CCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)N2C=C(C(=N2)C(=O)O)CCO)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O5/c16-6-5-8-7-14(13-11(8)12(17)18)9-3-1-2-4-10(9)15(19)20/h1-4,7,16H,5-6H2,(H,17,18)