5-[2-(2,2-dimethylpropanoyloxy)ethanoyl]-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid

Systemtic Name: 5-[2-(2,2-dimethylpropanoyloxy)ethanoyl]-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Openeye Name: 5-[2-(2,2-dimethylpropanoyloxy)acetyl]-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 5-[2-(2,2-dimethyl-1-oxopropoxy)-1-oxoethyl]-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 5-[2-(2,2-dimethylpropanoyloxy)acetyl]-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Traditional Name: 1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-5-(2-pivaloyloxyacetyl)-4H-pyridine-3-carboxylic acid Formula: C24H30N2O8 MolecularWeight: 474.5036

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Descriptors Computed from Structure

Canonical SMILES:

CCOCN1C(=C(C(C(=C1C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)COC(=O)C(C)(C)C)C

Isomeric SMILES

CCOCN1C(=C(C(C(=C1C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)COC(=O)C(C)(C)C)C

InChI

InChI=1S/C24H30N2O8/c1-7-33-13-25-14(2)19(18(27)12-34-23(30)24(4,5)6)21(20(15(25)3)22(28)29)16-9-8-10-17(11-16)26(31)32/h8-11,21H,7,12-13H2,1-6H3,(H,28,29)