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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrClN2O4/c1-11-10-15(17(19)12(2)18(11)20)26-9-5-8-16(23)21-13-6-3-4-7-14(13)22(24)25/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,21,23)