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

Systemtic Name: dipropan-2-yl 5-[[4-[(2-bromanylphenoxy)methyl]phenyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: diisopropyl 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 dipropan-2-yl ester IUPAC Name: dipropan-2-yl 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 diisopropyl ester Formula: C28H28BrNO6 MolecularWeight: 554.42902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28BrNO6/c1-17(2)35-27(32)21-13-22(28(33)36-18(3)4)15-23(14-21)30-26(31)20-11-9-19(10-12-20)16-34-25-8-6-5-7-24(25)29/h5-15,17-18H,16H2,1-4H3,(H,30,31)