N-(5-tert-butyl-2-oxidanyl-phenyl)-3-fluoranyl-4-methyl-5-nitro-benzamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-3-fluoranyl-4-methyl-5-nitro-benzamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-fluoro-4-methyl-5-nitro-benzamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-fluoro-4-methyl-5-nitrobenzamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-3-fluoro-4-methyl-5-nitrobenzamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-3-fluoro-4-methyl-5-nitro-benzamide Formula: C18H19FN2O4 MolecularWeight: 346.352863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C(=O)NC2=C(C=CC(=C2)C(C)(C)C)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1F)C(=O)NC2=C(C=CC(=C2)C(C)(C)C)O)[N+](=O)[O-]

InChI

InChI=1S/C18H19FN2O4/c1-10-13(19)7-11(8-15(10)21(24)25)17(23)20-14-9-12(18(2,3)4)5-6-16(14)22/h5-9,22H,1-4H3,(H,20,23)