N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-methyl-3-nitro-benzamide

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-methyl-3-nitro-benzamide Openeye Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-methyl-3-nitro-benzamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-methyl-3-nitrobenzamide IUPAC Name: N-(5-tert-butyl-2-phenylpyrazol-3-yl)-2-methyl-3-nitrobenzamide Traditional Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-methyl-3-nitro-benzamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC(=NN2C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC(=NN2C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C21H22N4O3/c1-14-16(11-8-12-17(14)25(27)28)20(26)22-19-13-18(21(2,3)4)23-24(19)15-9-6-5-7-10-15/h5-13H,1-4H3,(H,22,26)