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

Systemtic Name: N-[4-[[2-(4-bromanyl-2,6-dimethyl-phenoxy)propanoylamino]carbamoyl]phenyl]propanamide Openeye Name: N-[4-[[2-(4-bromo-2,6-dimethyl-phenoxy)propanoylamino]carbamoyl]phenyl]propanamide CAS Name: N-[4-[[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxopropyl]hydrazo]-oxomethyl]phenyl]propanamide IUPAC Name: N-[4-[[2-(4-bromo-2,6-dimethylphenoxy)propanoylamino]carbamoyl]phenyl]propanamide Traditional Name: N-[4-[[2-(4-bromo-2,6-dimethyl-phenoxy)propanoylamino]carbamoyl]phenyl]propionamide Formula: C21H24BrN3O4 MolecularWeight: 462.33696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C(C)OC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C(C)OC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C21H24BrN3O4/c1-5-18(26)23-17-8-6-15(7-9-17)21(28)25-24-20(27)14(4)29-19-12(2)10-16(22)11-13(19)3/h6-11,14H,5H2,1-4H3,(H,23,26)(H,24,27)(H,25,28)