N-(4-bromanyl-2-fluoranyl-phenyl)-4-(3-methylphenoxy)butanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-4-(3-methylphenoxy)butanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-4-(3-methylphenoxy)butanamide CAS Name: N-(4-bromo-2-fluorophenyl)-4-(3-methylphenoxy)butanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-4-(3-methylphenoxy)butanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-4-(3-methylphenoxy)butyramide Formula: C17H17BrFNO2 MolecularWeight: 366.224783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C17H17BrFNO2/c1-12-4-2-5-14(10-12)22-9-3-6-17(21)20-16-8-7-13(18)11-15(16)19/h2,4-5,7-8,10-11H,3,6,9H2,1H3,(H,20,21)