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

Systemtic Name: N-[4-[[2-(2-bromanyl-4-chloranyl-phenoxy)propanoylamino]carbamoyl]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[[2-(2-bromo-4-chloro-phenoxy)propanoylamino]carbamoyl]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[[2-(2-bromo-4-chlorophenoxy)-1-oxopropyl]hydrazo]-oxomethyl]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[[2-(2-bromo-4-chlorophenoxy)propanoylamino]carbamoyl]phenyl]-3-methylbutanamide Traditional Name: N-[4-[[2-(2-bromo-4-chloro-phenoxy)propanoylamino]carbamoyl]phenyl]-3-methyl-butyramide Formula: C21H23BrClN3O4 MolecularWeight: 496.78202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrClN3O4/c1-12(2)10-19(27)24-16-7-4-14(5-8-16)21(29)26-25-20(28)13(3)30-18-9-6-15(23)11-17(18)22/h4-9,11-13H,10H2,1-3H3,(H,24,27)(H,25,28)(H,26,29)