2-[4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoylamino]benzamide

Systemtic Name: 2-[4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoylamino]benzamide Openeye Name: 2-[4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butanoylamino]benzamide CAS Name: 2-[[4-(2-bromo-4-chloro-3,5-dimethylphenoxy)-1-oxobutyl]amino]benzamide IUPAC Name: 2-[4-(2-bromo-4-chloro-3,5-dimethylphenoxy)butanoylamino]benzamide Traditional Name: 2-[4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butanoylamino]benzamide Formula: C19H20BrClN2O3 MolecularWeight: 439.7307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)C)Br)OCCCC(=O)NC2=CC=CC=C2C(=O)N

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)C)Br)OCCCC(=O)NC2=CC=CC=C2C(=O)N

InChI

InChI=1S/C19H20BrClN2O3/c1-11-10-15(17(20)12(2)18(11)21)26-9-5-8-16(24)23-14-7-4-3-6-13(14)19(22)25/h3-4,6-7,10H,5,8-9H2,1-2H3,(H2,22,25)(H,23,24)