2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[2-methyl-3-(propanoylamino)phenyl]propanamide

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[2-methyl-3-(propanoylamino)phenyl]propanamide Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-[2-methyl-3-(propanoylamino)phenyl]propanamide CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[2-methyl-3-(1-oxopropylamino)phenyl]propanamide IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[2-methyl-3-(propanoylamino)phenyl]propanamide Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-(2-methyl-3-propionamido-phenyl)propionamide Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25BrN2O3/c1-6-19(25)23-17-8-7-9-18(14(17)4)24-21(26)15(5)27-20-12(2)10-16(22)11-13(20)3/h7-11,15H,6H2,1-5H3,(H,23,25)(H,24,26)