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

Systemtic Name: methyl (2E)-5-ethoxy-4-(2-methoxy-2-oxidanylidene-ethyl)-2-[(3-oxidanylidene-5-pyridin-3-yl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Openeye Name: methyl (2E)-5-ethoxy-4-(2-methoxy-2-oxo-ethyl)-2-[[3-oxo-5-(3-pyridyl)-1,2-dihydropyrazol-4-yl]methylene]pyrrole-3-carboxylate CAS Name: (2E)-5-ethoxy-4-(2-methoxy-2-oxoethyl)-2-[[3-oxo-5-(3-pyridinyl)-1,2-dihydropyrazol-4-yl]methylidene]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (2E)-5-ethoxy-4-(2-methoxy-2-oxoethyl)-2-[(3-oxo-5-pyridin-3-yl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Traditional Name: (2E)-5-ethoxy-4-(2-keto-2-methoxy-ethyl)-2-[[3-keto-5-(3-pyridyl)-3-pyrazolin-4-yl]methylene]pyrrole-3-carboxylic acid methyl ester Formula: C20H20N4O6 MolecularWeight: 412.396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=CC2=C(NNC2=O)C3=CN=CC=C3)C(=C1CC(=O)OC)C(=O)OC

Isomeric SMILES

CCOC1=N/C(=C/C2=C(NNC2=O)C3=CN=CC=C3)/C(=C1CC(=O)OC)C(=O)OC

InChI

InChI=1S/C20H20N4O6/c1-4-30-19-12(9-15(25)28-2)16(20(27)29-3)14(22-19)8-13-17(23-24-18(13)26)11-6-5-7-21-10-11/h5-8,10H,4,9H2,1-3H3,(H2,23,24,26)/b14-8+