N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide Openeye Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(5-nitro-2-oxo-1-pyridyl)acetamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide IUPAC Name: N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-(5-nitro-2-oxopyridin-1-yl)acetamide Traditional Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-(2-keto-5-nitro-1-pyridyl)acetamide Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H21N5O4/c1-20(2,3)16-11-17(24(22-16)14-7-5-4-6-8-14)21-18(26)13-23-12-15(25(28)29)9-10-19(23)27/h4-12H,13H2,1-3H3,(H,21,26)