methyl 2-[[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanoate

Systemtic Name: methyl 2-[[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylidene]-4,4-dimethyl-3-oxidanylidene-pentanoate Openeye Name: methyl 2-[[5-(2-bromo-4-nitro-phenyl)-2-furyl]methylene]-4,4-dimethyl-3-oxo-pentanoate CAS Name: 2-[[5-(2-bromo-4-nitrophenyl)-2-furanyl]methylidene]-4,4-dimethyl-3-oxopentanoic acid methyl ester IUPAC Name: methyl 2-[[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene]-4,4-dimethyl-3-oxopentanoate Traditional Name: 3-[5-(2-bromo-4-nitro-phenyl)-2-furyl]-2-pivaloyl-acrylic acid methyl ester Formula: C19H18BrNO6 MolecularWeight: 436.25332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC=C(O1)C2=C(C=C(C=C2)[N+](=O)[O-])Br)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)C(=CC1=CC=C(O1)C2=C(C=C(C=C2)[N+](=O)[O-])Br)C(=O)OC

InChI

InChI=1S/C19H18BrNO6/c1-19(2,3)17(22)14(18(23)26-4)10-12-6-8-16(27-12)13-7-5-11(21(24)25)9-15(13)20/h5-10H,1-4H3