3-nitro-N-(1-phenylethyl)-1H-pyrazole-5-carboxamide

Systemtic Name: 3-nitro-N-(1-phenylethyl)-1H-pyrazole-5-carboxamide Openeye Name: 3-nitro-N-(1-phenylethyl)-1H-pyrazole-5-carboxamide CAS Name: 3-nitro-N-(1-phenylethyl)-1H-pyrazole-5-carboxamide IUPAC Name: 3-nitro-N-(1-phenylethyl)-1H-pyrazole-5-carboxamide Traditional Name: 3-nitro-N-(1-phenylethyl)-1H-pyrazole-5-carboxamide Formula: C12H12N4O3 MolecularWeight: 260.24868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC(=NN2)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=CC(=NN2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O3/c1-8(9-5-3-2-4-6-9)13-12(17)10-7-11(15-14-10)16(18)19/h2-8H,1H3,(H,13,17)(H,14,15)