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

Systemtic Name: dimethyl 2-[(2-bromanyl-3,4,5-trimethoxy-phenyl)carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(2-bromo-3,4,5-trimethoxy-benzoyl)amino]benzene-1,4-dicarboxylate CAS Name: 2-[[(2-bromo-3,4,5-trimethoxyphenyl)-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-bromo-3,4,5-trimethoxybenzoyl)amino]benzene-1,4-dicarboxylate Traditional Name: 2-[(2-bromo-3,4,5-trimethoxy-benzoyl)amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C20H20BrNO8 MolecularWeight: 482.2787

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)Br)OC)OC

InChI

InChI=1S/C20H20BrNO8/c1-26-14-9-12(15(21)17(28-3)16(14)27-2)18(23)22-13-8-10(19(24)29-4)6-7-11(13)20(25)30-5/h6-9H,1-5H3,(H,22,23)