4-[4-(2-nitrophenyl)pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[4-(2-nitrophenyl)pyrazol-1-yl]benzoic acid Openeye Name: 4-[4-(2-nitrophenyl)pyrazol-1-yl]benzoic acid CAS Name: 4-[4-(2-nitrophenyl)-1-pyrazolyl]benzoic acid IUPAC Name: 4-[4-(2-nitrophenyl)pyrazol-1-yl]benzoic acid Traditional Name: 4-[4-(2-nitrophenyl)pyrazol-1-yl]benzoic acid Formula: C16H11N3O4 MolecularWeight: 309.27624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CN(N=C2)C3=CC=C(C=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=CN(N=C2)C3=CC=C(C=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O4/c20-16(21)11-5-7-13(8-6-11)18-10-12(9-17-18)14-3-1-2-4-15(14)19(22)23/h1-10H,(H,20,21)