N-(3-ethynylphenyl)-1H-pyrazole-4-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-1H-pyrazole-4-carboxamide Openeye Name: N-(3-ethynylphenyl)-1H-pyrazole-4-carboxamide CAS Name: N-(3-ethynylphenyl)-1H-pyrazole-4-carboxamide IUPAC Name: N-(3-ethynylphenyl)-1H-pyrazole-4-carboxamide Traditional Name: N-(3-ethynylphenyl)-1H-pyrazole-4-carboxamide Formula: C12H9N3O MolecularWeight: 211.21936

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2=CNN=C2

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2=CNN=C2

InChI

InChI=1S/C12H9N3O/c1-2-9-4-3-5-11(6-9)15-12(16)10-7-13-14-8-10/h1,3-8H,(H,13,14)(H,15,16)