diethyl 2,6-dimethyl-4-(3-nitrophenyl)-1-(propan-2-yloxymethyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2,6-dimethyl-4-(3-nitrophenyl)-1-(propan-2-yloxymethyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 1-(isopropoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1-(propan-2-yloxymethyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2,6-dimethyl-4-(3-nitrophenyl)-1-(propan-2-yloxymethyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(isopropoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C23H30N2O7 MolecularWeight: 446.4935

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C)COC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C)COC(C)C)C

InChI

InChI=1S/C23H30N2O7/c1-7-30-22(26)19-15(5)24(13-32-14(3)4)16(6)20(23(27)31-8-2)21(19)17-10-9-11-18(12-17)25(28)29/h9-12,14,21H,7-8,13H2,1-6H3