2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)butanamide

Systemtic Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)butanamide Openeye Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)butanamide CAS Name: 2-(5-methyl-3-nitro-1-pyrazolyl)-N-[3-(1-pyrazolyl)propyl]butanamide IUPAC Name: 2-(5-methyl-3-nitropyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)butanamide Traditional Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-(3-pyrazol-1-ylpropyl)butyramide Formula: C14H20N6O3 MolecularWeight: 320.347

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCCN1C=CC=N1)N2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NCCCN1C=CC=N1)N2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C14H20N6O3/c1-3-12(19-11(2)10-13(17-19)20(22)23)14(21)15-6-4-8-18-9-5-7-16-18/h5,7,9-10,12H,3-4,6,8H2,1-2H3,(H,15,21)