N-(5-tert-butyl-2-oxidanyl-phenyl)-1-(4-nitrophenyl)pyrazole-4-carboxamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-1-(4-nitrophenyl)pyrazole-4-carboxamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(4-nitrophenyl)pyrazole-4-carboxamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-(4-nitrophenyl)-4-pyrazolecarboxamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-(4-nitrophenyl)pyrazole-4-carboxamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(4-nitrophenyl)pyrazole-4-carboxamide Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2=CN(N=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-20(2,3)14-4-9-18(25)17(10-14)22-19(26)13-11-21-23(12-13)15-5-7-16(8-6-15)24(27)28/h4-12,25H,1-3H3,(H,22,26)