2-(4-nitropyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butanamide

Systemtic Name: 2-(4-nitropyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butanamide Openeye Name: 2-(4-nitropyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butanamide CAS Name: 2-(4-nitro-1-pyrazolyl)-N-[3-(1-pyrazolylmethyl)phenyl]butanamide IUPAC Name: 2-(4-nitropyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butanamide Traditional Name: 2-(4-nitropyrazol-1-yl)-N-[3-(pyrazol-1-ylmethyl)phenyl]butyramide Formula: C17H18N6O3 MolecularWeight: 354.36322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)CN2C=CC=N2)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)CN2C=CC=N2)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O3/c1-2-16(22-12-15(10-19-22)23(25)26)17(24)20-14-6-3-5-13(9-14)11-21-8-4-7-18-21/h3-10,12,16H,2,11H2,1H3,(H,20,24)