N-[1,5-dimethyl-3-[2-(4-nitrophenyl)ethynyl]pyrazol-4-yl]ethanamide

Systemtic Name: N-[1,5-dimethyl-3-[2-(4-nitrophenyl)ethynyl]pyrazol-4-yl]ethanamide Openeye Name: N-[1,5-dimethyl-3-[2-(4-nitrophenyl)ethynyl]pyrazol-4-yl]acetamide CAS Name: N-[1,5-dimethyl-3-[2-(4-nitrophenyl)ethynyl]-4-pyrazolyl]acetamide IUPAC Name: N-[1,5-dimethyl-3-[2-(4-nitrophenyl)ethynyl]pyrazol-4-yl]acetamide Traditional Name: N-[1,5-dimethyl-3-[2-(4-nitrophenyl)ethynyl]pyrazol-4-yl]acetamide Formula: C15H14N4O3 MolecularWeight: 298.29666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C#CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CC1=C(C(=NN1C)C#CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C15H14N4O3/c1-10-15(16-11(2)20)14(17-18(10)3)9-6-12-4-7-13(8-5-12)19(21)22/h4-5,7-8H,1-3H3,(H,16,20)