dimethyl 5-[[4-[(2-bromanylphenoxy)methyl]phenyl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[4-[(2-bromanylphenoxy)methyl]phenyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-[(2-bromophenoxy)methyl]benzoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[4-[(2-bromophenoxy)methyl]phenyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-[(2-bromophenoxy)methyl]benzoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-[(2-bromophenoxy)methyl]benzoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C24H20BrNO6 MolecularWeight: 498.3227

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)COC3=CC=CC=C3Br)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)COC3=CC=CC=C3Br)C(=O)OC

InChI

InChI=1S/C24H20BrNO6/c1-30-23(28)17-11-18(24(29)31-2)13-19(12-17)26-22(27)16-9-7-15(8-10-16)14-32-21-6-4-3-5-20(21)25/h3-13H,14H2,1-2H3,(H,26,27)