ditert-butyl 2-(4-nitrophenyl)-2-(pyridin-2-ylmethyl)propanedioate

Systemtic Name: ditert-butyl 2-(4-nitrophenyl)-2-(pyridin-2-ylmethyl)propanedioate Openeye Name: ditert-butyl 2-(4-nitrophenyl)-2-(2-pyridylmethyl)propanedioate CAS Name: 2-(4-nitrophenyl)-2-(2-pyridinylmethyl)propanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-(4-nitrophenyl)-2-(pyridin-2-ylmethyl)propanedioate Traditional Name: 2-(4-nitrophenyl)-2-(2-pyridylmethyl)malonic acid ditert-butyl ester Formula: C23H28N2O6 MolecularWeight: 428.47822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=CC=N1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CC=CC=N1)(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)(C)C

InChI

InChI=1S/C23H28N2O6/c1-21(2,3)30-19(26)23(20(27)31-22(4,5)6,15-17-9-7-8-14-24-17)16-10-12-18(13-11-16)25(28)29/h7-14H,15H2,1-6H3