tripropan-2-yl 3-(4-nitrophenyl)-3-oxidanylidene-propane-1,1,1-tricarboxylate

Systemtic Name: tripropan-2-yl 3-(4-nitrophenyl)-3-oxidanylidene-propane-1,1,1-tricarboxylate Openeye Name: triisopropyl 3-(4-nitrophenyl)-3-oxo-propane-1,1,1-tricarboxylate CAS Name: 3-(4-nitrophenyl)-3-oxopropane-1,1,1-tricarboxylic acid tripropan-2-yl ester IUPAC Name: tripropan-2-yl 3-(4-nitrophenyl)-3-oxopropane-1,1,1-tricarboxylate Traditional Name: 3-keto-3-(4-nitrophenyl)propane-1,1,1-tricarboxylic acid triisopropyl ester Formula: C21H27NO9 MolecularWeight: 437.44038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO9/c1-12(2)29-18(24)21(19(25)30-13(3)4,20(26)31-14(5)6)11-17(23)15-7-9-16(10-8-15)22(27)28/h7-10,12-14H,11H2,1-6H3