bis(phenylmethyl) 5-[(2-methylpropan-2-yl)oxycarbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: bis(phenylmethyl) 5-[(2-methylpropan-2-yl)oxycarbonylamino]benzene-1,3-dicarboxylate Openeye Name: dibenzyl 5-(tert-butoxycarbonylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzene-1,3-dicarboxylic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 5-[(2-methylpropan-2-yl)oxycarbonylamino]benzene-1,3-dicarboxylate Traditional Name: 5-(tert-butoxycarbonylamino)benzene-1,3-dicarboxylic acid dibenzyl ester Formula: C27H27NO6 MolecularWeight: 461.50638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=CC(=C1)C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=CC(=C1)C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H27NO6/c1-27(2,3)34-26(31)28-23-15-21(24(29)32-17-19-10-6-4-7-11-19)14-22(16-23)25(30)33-18-20-12-8-5-9-13-20/h4-16H,17-18H2,1-3H3,(H,28,31)