3-nitro-4-pyrazol-1-yl-benzoic acid

Systemtic Name: 3-nitro-4-pyrazol-1-yl-benzoic acid Openeye Name: 3-nitro-4-pyrazol-1-yl-benzoic acid CAS Name: 3-nitro-4-(1-pyrazolyl)benzoic acid IUPAC Name: 3-nitro-4-pyrazol-1-ylbenzoic acid Traditional Name: 3-nitro-4-pyrazol-1-yl-benzoic acid Formula: C10H7N3O4 MolecularWeight: 233.18028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7N3O4/c14-10(15)7-2-3-8(9(6-7)13(16)17)12-5-1-4-11-12/h1-6H,(H,14,15)