1-(5-bromanyl-2,4-dimethyl-furan-3-yl)ethanone; 1-(2,4-dimethyl-5-pyridin-4-yl-furan-3-yl)ethanone

Systemtic Name: 1-(5-bromanyl-2,4-dimethyl-furan-3-yl)ethanone; 1-(2,4-dimethyl-5-pyridin-4-yl-furan-3-yl)ethanone Openeye Name: 1-(5-bromo-2,4-dimethyl-3-furyl)ethanone; 1-[2,4-dimethyl-5-(4-pyridyl)-3-furyl]ethanone CAS Name: 1-(5-bromo-2,4-dimethyl-3-furanyl)ethanone; 1-(2,4-dimethyl-5-pyridin-4-yl-3-furanyl)ethanone IUPAC Name: 1-(5-bromo-2,4-dimethylfuran-3-yl)ethanone; 1-(2,4-dimethyl-5-pyridin-4-ylfuran-3-yl)ethanone Traditional Name: 1-(5-bromo-2,4-dimethyl-3-furyl)ethanone; 1-[2,4-dimethyl-5-(4-pyridyl)-3-furyl]ethanone Formula: C21H22BrNO4 MolecularWeight: 432.30768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C(=O)C)C)C2=CC=NC=C2.CC1=C(OC(=C1C(=O)C)C)Br

Isomeric SMILES

CC1=C(OC(=C1C(=O)C)C)C2=CC=NC=C2.CC1=C(OC(=C1C(=O)C)C)Br

InChI

InChI=1S/C13H13NO2.C8H9BrO2/c1-8-12(9(2)15)10(3)16-13(8)11-4-6-14-7-5-11;1-4-7(5(2)10)6(3)11-8(4)9/h4-7H,1-3H3;1-3H3