N-(2-bromanyl-4-nitro-phenyl)-4-(4-chloranyl-3,5-dimethyl-phenoxy)butanamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-4-(4-chloranyl-3,5-dimethyl-phenoxy)butanamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-4-(4-chloro-3,5-dimethyl-phenoxy)butanamide CAS Name: N-(2-bromo-4-nitrophenyl)-4-(4-chloro-3,5-dimethylphenoxy)butanamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-4-(4-chloro-3,5-dimethylphenoxy)butanamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-4-(4-chloro-3,5-dimethyl-phenoxy)butyramide Formula: C18H18BrClN2O4 MolecularWeight: 441.70352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C18H18BrClN2O4/c1-11-8-14(9-12(2)18(11)20)26-7-3-4-17(23)21-16-6-5-13(22(24)25)10-15(16)19/h5-6,8-10H,3-4,7H2,1-2H3,(H,21,23)