N-(4-bromanyl-2,6-diethyl-phenyl)-2-butyl-5-chloranyl-6-methyl-4-oxidanylidene-pyran-3-carboxamide

Systemtic Name: N-(4-bromanyl-2,6-diethyl-phenyl)-2-butyl-5-chloranyl-6-methyl-4-oxidanylidene-pyran-3-carboxamide Openeye Name: N-(4-bromo-2,6-diethyl-phenyl)-2-butyl-5-chloro-6-methyl-4-oxo-pyran-3-carboxamide CAS Name: N-(4-bromo-2,6-diethylphenyl)-2-butyl-5-chloro-6-methyl-4-oxo-3-pyrancarboxamide IUPAC Name: N-(4-bromo-2,6-diethylphenyl)-2-butyl-5-chloro-6-methyl-4-oxopyran-3-carboxamide Traditional Name: N-(4-bromo-2,6-diethyl-phenyl)-2-butyl-5-chloro-4-keto-6-methyl-pyran-3-carboxamide Formula: C21H25BrClNO3 MolecularWeight: 454.7851

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)C(=C(O1)C)Cl)C(=O)NC2=C(C=C(C=C2CC)Br)CC

Isomeric SMILES

CCCCC1=C(C(=O)C(=C(O1)C)Cl)C(=O)NC2=C(C=C(C=C2CC)Br)CC

InChI

InChI=1S/C21H25BrClNO3/c1-5-8-9-16-17(20(25)18(23)12(4)27-16)21(26)24-19-13(6-2)10-15(22)11-14(19)7-3/h10-11H,5-9H2,1-4H3,(H,24,26)