O2-tert-butyl O1,O3-bis(4-nitrophenyl) 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: O2-tert-butyl O1,O3-bis(4-nitrophenyl) 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: O2-tert-butyl O1,O3-bis(4-nitrophenyl) 2-hydroxypropane-1,2,3-tricarboxylate CAS Name: 2-hydroxypropane-1,2,3-tricarboxylic acid O2-tert-butyl ester O1,O3-bis(4-nitrophenyl) ester IUPAC Name: 2-O-tert-butyl 1-O,3-O-bis(4-nitrophenyl) 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 2-hydroxypropane-1,2,3-tricarboxylic acid O2-tert-butyl ester O1,O3-bis(4-nitrophenyl) ester Formula: C22H22N2O11 MolecularWeight: 490.41688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])(CC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)OC(=O)C(CC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])(CC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C22H22N2O11/c1-21(2,3)35-20(27)22(28,12-18(25)33-16-8-4-14(5-9-16)23(29)30)13-19(26)34-17-10-6-15(7-11-17)24(31)32/h4-11,28H,12-13H2,1-3H3