N-[4-[2-(2-bromanyl-4-chloranyl-phenoxy)propanoylamino]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[2-(2-bromanyl-4-chloranyl-phenoxy)propanoylamino]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[2-(2-bromo-4-chloro-phenoxy)propanoylamino]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[2-(2-bromo-4-chlorophenoxy)-1-oxopropyl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[2-(2-bromo-4-chlorophenoxy)propanoylamino]phenyl]-3-methylbutanamide Traditional Name: N-[4-[2-(2-bromo-4-chloro-phenoxy)propanoylamino]phenyl]-3-methyl-butyramide Formula: C20H22BrClN2O3 MolecularWeight: 453.75728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C20H22BrClN2O3/c1-12(2)10-19(25)23-15-5-7-16(8-6-15)24-20(26)13(3)27-18-9-4-14(22)11-17(18)21/h4-9,11-13H,10H2,1-3H3,(H,23,25)(H,24,26)