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

Systemtic Name: ethyl (5E)-5-[(3-cyclopropyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methylidene]-4-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl (5E)-5-[(3-cyclopropyl-5-oxo-1,2-dihydropyrazol-4-yl)methylene]-4-phenyl-pyrrole-3-carboxylate CAS Name: (5E)-5-[(3-cyclopropyl-5-oxo-1,2-dihydropyrazol-4-yl)methylidene]-4-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[(3-cyclopropyl-5-oxo-1,2-dihydropyrazol-4-yl)methylidene]-4-phenylpyrrole-3-carboxylate Traditional Name: (5E)-5-[(3-cyclopropyl-5-keto-3-pyrazolin-4-yl)methylene]-4-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC2=C(NNC2=O)C3CC3)N=C1)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(/C(=C\C2=C(NNC2=O)C3CC3)/N=C1)C4=CC=CC=C4

InChI

InChI=1S/C20H19N3O3/c1-2-26-20(25)15-11-21-16(17(15)12-6-4-3-5-7-12)10-14-18(13-8-9-13)22-23-19(14)24/h3-7,10-11,13H,2,8-9H2,1H3,(H2,22,23,24)/b16-10+