dimethyl 5-[(5-bromanylpyridin-3-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(5-bromanylpyridin-3-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(5-bromopyridine-3-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(5-bromopyridine-3-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(5-bromonicotinoyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C16H13BrN2O5 MolecularWeight: 393.18882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC(=CN=C2)Br)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC(=CN=C2)Br)C(=O)OC

InChI

InChI=1S/C16H13BrN2O5/c1-23-15(21)9-3-10(16(22)24-2)6-13(5-9)19-14(20)11-4-12(17)8-18-7-11/h3-8H,1-2H3,(H,19,20)