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

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-[3-(propanoylamino)phenyl]propanamide Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-[3-(propanoylamino)phenyl]propanamide CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[3-(1-oxopropylamino)phenyl]propanamide IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[3-(propanoylamino)phenyl]propanamide Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-(3-propionamidophenyl)propionamide Formula: C20H23BrN2O3 MolecularWeight: 419.31222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O3/c1-5-18(24)22-16-7-6-8-17(11-16)23-20(25)14(4)26-19-12(2)9-15(21)10-13(19)3/h6-11,14H,5H2,1-4H3,(H,22,24)(H,23,25)