N-[4-[[2-(4-bromanyl-2,6-dimethyl-phenoxy)propanoylamino]carbamoyl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[[2-(4-bromanyl-2,6-dimethyl-phenoxy)propanoylamino]carbamoyl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[[2-(4-bromo-2,6-dimethyl-phenoxy)propanoylamino]carbamoyl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxopropyl]hydrazo]-oxomethyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[[2-(4-bromo-2,6-dimethylphenoxy)propanoylamino]carbamoyl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[2-(4-bromo-2,6-dimethyl-phenoxy)propanoylamino]carbamoyl]phenyl]cyclohexanecarboxamide Formula: C25H30BrN3O4 MolecularWeight: 516.4274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(C)C(=O)NNC(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(C)C(=O)NNC(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3)C)Br

InChI

InChI=1S/C25H30BrN3O4/c1-15-13-20(26)14-16(2)22(15)33-17(3)23(30)28-29-25(32)19-9-11-21(12-10-19)27-24(31)18-7-5-4-6-8-18/h9-14,17-18H,4-8H2,1-3H3,(H,27,31)(H,28,30)(H,29,32)