ethyl (5E)-2,4-dimethyl-5-[(3-oxidanylidene-5-phenyl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate

Systemtic Name: ethyl (5E)-2,4-dimethyl-5-[(3-oxidanylidene-5-phenyl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Openeye Name: ethyl (5E)-2,4-dimethyl-5-[(3-oxo-5-phenyl-1,2-dihydropyrazol-4-yl)methylene]pyrrole-3-carboxylate CAS Name: (5E)-2,4-dimethyl-5-[(3-oxo-5-phenyl-1,2-dihydropyrazol-4-yl)methylidene]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (5E)-2,4-dimethyl-5-[(3-oxo-5-phenyl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Traditional Name: (5E)-5-[(3-keto-5-phenyl-3-pyrazolin-4-yl)methylene]-2,4-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC2=C(NNC2=O)C3=CC=CC=C3)N=C1C)C

Isomeric SMILES

CCOC(=O)C1=C(/C(=C\C2=C(NNC2=O)C3=CC=CC=C3)/N=C1C)C

InChI

InChI=1S/C19H19N3O3/c1-4-25-19(24)16-11(2)15(20-12(16)3)10-14-17(21-22-18(14)23)13-8-6-5-7-9-13/h5-10H,4H2,1-3H3,(H2,21,22,23)/b15-10+