2-(4-nitropyrazol-1-yl)-N-phenyl-butanamide

Systemtic Name: 2-(4-nitropyrazol-1-yl)-N-phenyl-butanamide Openeye Name: 2-(4-nitropyrazol-1-yl)-N-phenyl-butanamide CAS Name: 2-(4-nitro-1-pyrazolyl)-N-phenylbutanamide IUPAC Name: 2-(4-nitropyrazol-1-yl)-N-phenylbutanamide Traditional Name: 2-(4-nitropyrazol-1-yl)-N-phenyl-butyramide Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3/c1-2-12(16-9-11(8-14-16)17(19)20)13(18)15-10-6-4-3-5-7-10/h3-9,12H,2H2,1H3,(H,15,18)