methyl 6-hexyl-5-imidazol-1-ylcarbonyl-2-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylate

Systemtic Name: methyl 6-hexyl-5-imidazol-1-ylcarbonyl-2-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylate Openeye Name: methyl 6-hexyl-5-(imidazole-1-carbonyl)-2-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: 6-hexyl-5-[1-imidazolyl(oxo)methyl]-2-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-hexyl-5-(imidazole-1-carbonyl)-2-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylate Traditional Name: 6-hexyl-5-(imidazole-1-carbonyl)-2-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid methyl ester Formula: C24H28N4O5 MolecularWeight: 452.50292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(CC(=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)OC)C(=O)N3C=CN=C3

Isomeric SMILES

CCCCCCC1=C(CC(=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)OC)C(=O)N3C=CN=C3

InChI

InChI=1S/C24H28N4O5/c1-4-5-6-7-8-22-21(23(29)26-14-13-25-16-26)15-20(24(30)33-3)17(2)27(22)18-9-11-19(12-10-18)28(31)32/h9-14,16H,4-8,15H2,1-3H3