5-(2,2-dimethylpropanoyloxy)-1-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid

Systemtic Name: 5-(2,2-dimethylpropanoyloxy)-1-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Openeye Name: 5-(2,2-dimethylpropanoyloxy)-1-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 5-(2,2-dimethyl-1-oxopropoxy)-1-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 5-(2,2-dimethylpropanoyloxy)-1-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Traditional Name: 1-carbomethoxy-2,6-dimethyl-4-(3-nitrophenyl)-5-pivaloyloxy-4H-pyridine-3-carboxylic acid Formula: C21H24N2O8 MolecularWeight: 432.42386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1C(=O)OC)C)OC(=O)C(C)(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1C(=O)OC)C)OC(=O)C(C)(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C21H24N2O8/c1-11-15(18(24)25)16(13-8-7-9-14(10-13)23(28)29)17(31-19(26)21(3,4)5)12(2)22(11)20(27)30-6/h7-10,16H,1-6H3,(H,24,25)