1-butyl-5-[(2E,4E)-hexa-2,4-dienoxy]carbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid

Systemtic Name: 1-butyl-5-[(2E,4E)-hexa-2,4-dienoxy]carbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Openeye Name: 1-butyl-5-[(2E,4E)-hexa-2,4-dienoxy]carbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 1-butyl-5-[[(2E,4E)-hexa-2,4-dienoxy]-oxomethyl]-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 1-butyl-5-[(2E,4E)-hexa-2,4-dienoxy]carbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Traditional Name: 1-butyl-5-[(2E,4E)-hexa-2,4-dienoxy]carbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(C(=C1C)C(=O)OCC=CC=CC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C

Isomeric SMILES

CCCCN1C(=C(C(C(=C1C)C(=O)OC/C=C/C=C/C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C

InChI

InChI=1S/C25H30N2O6/c1-5-7-9-10-15-33-25(30)22-18(4)26(14-8-6-2)17(3)21(24(28)29)23(22)19-12-11-13-20(16-19)27(31)32/h5,7,9-13,16,23H,6,8,14-15H2,1-4H3,(H,28,29)/b7-5+,10-9+