ethyl 5-ethanoyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Openeye Name: ethyl 5-acetyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: 5-acetyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Traditional Name: 5-acetyl-1-(ethoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid ethyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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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)C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O6/c1-6-28-12-22-13(3)18(15(5)24)20(19(14(22)4)21(25)29-7-2)16-9-8-10-17(11-16)23(26)27/h8-11,20H,6-7,12H2,1-5H3