4-(2-cyanophenyl)-6-methanoyl-5-methoxycarbonyl-2-methyl-1-propyl-4H-pyridine-3-carboxylate

Systemtic Name: 4-(2-cyanophenyl)-6-methanoyl-5-methoxycarbonyl-2-methyl-1-propyl-4H-pyridine-3-carboxylate Openeye Name: 4-(2-cyanophenyl)-6-formyl-5-methoxycarbonyl-2-methyl-1-propyl-4H-pyridine-3-carboxylate CAS Name: 4-(2-cyanophenyl)-6-formyl-5-methoxycarbonyl-2-methyl-1-propyl-4H-pyridine-3-carboxylate IUPAC Name: 4-(2-cyanophenyl)-6-formyl-5-methoxycarbonyl-2-methyl-1-propyl-4H-pyridine-3-carboxylate Traditional Name: 5-carbomethoxy-4-(2-cyanophenyl)-6-formyl-2-methyl-1-propyl-4H-pyridine-3-carboxylate Formula: C20H19N2O5- MolecularWeight: 367.37526

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(C(=C1C=O)C(=O)OC)C2=CC=CC=C2C#N)C(=O)[O-])C

Isomeric SMILES

CCCN1C(=C(C(C(=C1C=O)C(=O)OC)C2=CC=CC=C2C#N)C(=O)[O-])C

InChI

InChI=1S/C20H20N2O5/c1-4-9-22-12(2)16(19(24)25)17(14-8-6-5-7-13(14)10-21)18(15(22)11-23)20(26)27-3/h5-8,11,17H,4,9H2,1-3H3,(H,24,25)/p-1