5-[2-bromanyl-4-(trifluoromethyl)phenoxy]-N-but-3-en-2-yl-2-nitro-benzamide

Systemtic Name: 5-[2-bromanyl-4-(trifluoromethyl)phenoxy]-N-but-3-en-2-yl-2-nitro-benzamide Openeye Name: 5-[2-bromo-4-(trifluoromethyl)phenoxy]-N-(1-methylallyl)-2-nitro-benzamide CAS Name: 5-[2-bromo-4-(trifluoromethyl)phenoxy]-N-but-3-en-2-yl-2-nitrobenzamide IUPAC Name: 5-[2-bromo-4-(trifluoromethyl)phenoxy]-N-but-3-en-2-yl-2-nitrobenzamide Traditional Name: 5-[2-bromo-4-(trifluoromethyl)phenoxy]-N-(1-methylallyl)-2-nitro-benzamide Formula: C18H14BrF3N2O4 MolecularWeight: 459.21397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C=C)NC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H14BrF3N2O4/c1-3-10(2)23-17(25)13-9-12(5-6-15(13)24(26)27)28-16-7-4-11(8-14(16)19)18(20,21)22/h3-10H,1H2,2H3,(H,23,25)