bis(2,2-dimethylpropanoyloxymethyl) 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: bis(2,2-dimethylpropanoyloxymethyl) 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: bis(2,2-dimethylpropanoyloxymethyl) 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid bis[(2,2-dimethyl-1-oxopropoxy)methyl] ester IUPAC Name: bis(2,2-dimethylpropanoyloxymethyl) 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid bis(pivaloyloxymethyl) ester Formula: C29H38N2O11 MolecularWeight: 590.61882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1COC)C)C(=O)OCOC(=O)C(C)(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCOC(=O)C(C)(C)C

Isomeric SMILES

CC1=C(C(C(=C(N1COC)C)C(=O)OCOC(=O)C(C)(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCOC(=O)C(C)(C)C

InChI

InChI=1S/C29H38N2O11/c1-17-21(24(32)39-15-41-26(34)28(3,4)5)23(19-11-10-12-20(13-19)31(36)37)22(18(2)30(17)14-38-9)25(33)40-16-42-27(35)29(6,7)8/h10-13,23H,14-16H2,1-9H3