4-(2-bromanyl-4-tert-butyl-phenoxy)-N-(3-nitrophenyl)butanamide

Systemtic Name: 4-(2-bromanyl-4-tert-butyl-phenoxy)-N-(3-nitrophenyl)butanamide Openeye Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-(3-nitrophenyl)butanamide CAS Name: 4-(2-bromo-4-tert-butylphenoxy)-N-(3-nitrophenyl)butanamide IUPAC Name: 4-(2-bromo-4-tert-butylphenoxy)-N-(3-nitrophenyl)butanamide Traditional Name: 4-(2-bromo-4-tert-butyl-phenoxy)-N-(3-nitrophenyl)butyramide Formula: C20H23BrN2O4 MolecularWeight: 435.31162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O4/c1-20(2,3)14-9-10-18(17(21)12-14)27-11-5-8-19(24)22-15-6-4-7-16(13-15)23(25)26/h4,6-7,9-10,12-13H,5,8,11H2,1-3H3,(H,22,24)