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

Systemtic Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-5-(propanoyloxymethoxycarbonyl)-4H-pyridine-3-carboxylic acid Openeye Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-5-(propanoyloxymethoxycarbonyl)-4H-pyridine-3-carboxylic acid CAS Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-5-[oxo(1-oxopropoxymethoxy)methyl]-4H-pyridine-3-carboxylic acid IUPAC Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-5-(propanoyloxymethoxycarbonyl)-4H-pyridine-3-carboxylic acid Traditional Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-5-(propionyloxymethoxycarbonyl)-4H-pyridine-3-carboxylic acid Formula: C21H24N2O9 MolecularWeight: 448.42326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C)COC)C

Isomeric SMILES

CCC(=O)OCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C)COC)C

InChI

InChI=1S/C21H24N2O9/c1-5-16(24)31-11-32-21(27)18-13(3)22(10-30-4)12(2)17(20(25)26)19(18)14-7-6-8-15(9-14)23(28)29/h6-9,19H,5,10-11H2,1-4H3,(H,25,26)