N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-(3-methylphenoxy)butanamide

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-(3-methylphenoxy)butanamide Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-4-(3-methylphenoxy)butanamide CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-4-(3-methylphenoxy)butanamide IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-4-(3-methylphenoxy)butanamide Traditional Name: N-(5-bromo-2-fluoro-benzyl)-4-(3-methylphenoxy)butyramide Formula: C18H19BrFNO2 MolecularWeight: 380.251363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NCC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)NCC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C18H19BrFNO2/c1-13-4-2-5-16(10-13)23-9-3-6-18(22)21-12-14-11-15(19)7-8-17(14)20/h2,4-5,7-8,10-11H,3,6,9,12H2,1H3,(H,21,22)