N-(2-bromanyl-4-nitro-phenyl)-4-[4-(2-methylbutan-2-yl)phenoxy]butanamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-4-[4-(2-methylbutan-2-yl)phenoxy]butanamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-4-[4-(1,1-dimethylpropyl)phenoxy]butanamide CAS Name: N-(2-bromo-4-nitrophenyl)-4-[4-(2-methylbutan-2-yl)phenoxy]butanamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-4-[4-(2-methylbutan-2-yl)phenoxy]butanamide Traditional Name: 4-(4-tert-amylphenoxy)-N-(2-bromo-4-nitro-phenyl)butyramide Formula: C21H25BrN2O4 MolecularWeight: 449.3382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCCCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCCCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C21H25BrN2O4/c1-4-21(2,3)15-7-10-17(11-8-15)28-13-5-6-20(25)23-19-12-9-16(24(26)27)14-18(19)22/h7-12,14H,4-6,13H2,1-3H3,(H,23,25)