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

Systemtic Name: 5-ethoxycarbonyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Openeye Name: 5-ethoxycarbonyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 5-ethoxycarbonyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 5-ethoxycarbonyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Traditional Name: 5-carbethoxy-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Formula: C20H24N2O7 MolecularWeight: 404.41376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O7/c1-5-28-11-21-12(3)16(19(23)24)18(17(13(21)4)20(25)29-6-2)14-8-7-9-15(10-14)22(26)27/h7-10,18H,5-6,11H2,1-4H3,(H,23,24)