ethyl (5E)-5-[ethoxy(oxidanyl)methylidene]-1-methyl-4-oxidanylidene-2-pyridin-4-yl-pyrrole-3-carboxylate

Systemtic Name: ethyl (5E)-5-[ethoxy(oxidanyl)methylidene]-1-methyl-4-oxidanylidene-2-pyridin-4-yl-pyrrole-3-carboxylate Openeye Name: ethyl (5E)-5-[ethoxy(hydroxy)methylene]-1-methyl-4-oxo-2-(4-pyridyl)pyrrole-3-carboxylate CAS Name: (5E)-5-[ethoxy(hydroxy)methylidene]-1-methyl-4-oxo-2-pyridin-4-yl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[ethoxy(hydroxy)methylidene]-1-methyl-4-oxo-2-pyridin-4-ylpyrrole-3-carboxylate Traditional Name: (5E)-5-[ethoxy(hydroxy)methylene]-4-keto-1-methyl-2-(4-pyridyl)-2-pyrroline-3-carboxylic acid ethyl ester Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C(O)OCC)C1=O)C)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)C1=C(N(/C(=C(\O)/OCC)/C1=O)C)C2=CC=NC=C2

InChI

InChI=1S/C16H18N2O5/c1-4-22-15(20)11-12(10-6-8-17-9-7-10)18(3)13(14(11)19)16(21)23-5-2/h6-9,21H,4-5H2,1-3H3/b16-13+