5-ethynyl-3-(4-nitrophenyl)-1H-pyrazole

Systemtic Name: 5-ethynyl-3-(4-nitrophenyl)-1H-pyrazole Openeye Name: 5-ethynyl-3-(4-nitrophenyl)-1H-pyrazole CAS Name: 5-ethynyl-3-(4-nitrophenyl)-1H-pyrazole IUPAC Name: 5-ethynyl-3-(4-nitrophenyl)-1H-pyrazole Traditional Name: 5-ethynyl-3-(4-nitrophenyl)-1H-pyrazole Formula: C11H7N3O2 MolecularWeight: 213.19218

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=NN1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C#CC1=CC(=NN1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H7N3O2/c1-2-9-7-11(13-12-9)8-3-5-10(6-4-8)14(15)16/h1,3-7H,(H,12,13)