dibutyl 1,2,6-trimethyl-4-(4-methyl-3-nitro-phenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dibutyl 1,2,6-trimethyl-4-(4-methyl-3-nitro-phenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: dibutyl 1,2,6-trimethyl-4-(4-methyl-3-nitro-phenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1,2,6-trimethyl-4-(4-methyl-3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid dibutyl ester IUPAC Name: dibutyl 1,2,6-trimethyl-4-(4-methyl-3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1,2,6-trimethyl-4-(4-methyl-3-nitro-phenyl)-4H-pyridine-3,5-dicarboxylic acid dibutyl ester Formula: C25H34N2O6 MolecularWeight: 458.54726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(N(C(=C(C1C2=CC(=C(C=C2)C)[N+](=O)[O-])C(=O)OCCCC)C)C)C

Isomeric SMILES

CCCCOC(=O)C1=C(N(C(=C(C1C2=CC(=C(C=C2)C)[N+](=O)[O-])C(=O)OCCCC)C)C)C

InChI

InChI=1S/C25H34N2O6/c1-7-9-13-32-24(28)21-17(4)26(6)18(5)22(25(29)33-14-10-8-2)23(21)19-12-11-16(3)20(15-19)27(30)31/h11-12,15,23H,7-10,13-14H2,1-6H3