ethyl 4-acetyloxy-5-bromanyl-2-methyl-6-[2-(5-nitrofuran-2-yl)ethenyl]pyridine-3-carboxylate

Systemtic Name: ethyl 4-acetyloxy-5-bromanyl-2-methyl-6-[2-(5-nitrofuran-2-yl)ethenyl]pyridine-3-carboxylate Openeye Name: ethyl 4-acetoxy-5-bromo-2-methyl-6-[2-(5-nitro-2-furyl)vinyl]pyridine-3-carboxylate CAS Name: 4-acetyloxy-5-bromo-2-methyl-6-[2-(5-nitro-2-furanyl)ethenyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyloxy-5-bromo-2-methyl-6-[2-(5-nitrofuran-2-yl)ethenyl]pyridine-3-carboxylate Traditional Name: 4-acetoxy-5-bromo-2-methyl-6-[2-(5-nitro-2-furyl)vinyl]nicotinic acid ethyl ester Formula: C17H15BrN2O7 MolecularWeight: 439.2142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N=C1C)C=CC2=CC=C(O2)[N+](=O)[O-])Br)OC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N=C1C)C=CC2=CC=C(O2)[N+](=O)[O-])Br)OC(=O)C

InChI

InChI=1S/C17H15BrN2O7/c1-4-25-17(22)14-9(2)19-12(15(18)16(14)26-10(3)21)7-5-11-6-8-13(27-11)20(23)24/h5-8H,4H2,1-3H3