ethyl (5E)-5-[nitroso(phenyl)methylidene]-4-phenyl-1,2-dihydropyrazole-3-carboxylate

Systemtic Name: ethyl (5E)-5-[nitroso(phenyl)methylidene]-4-phenyl-1,2-dihydropyrazole-3-carboxylate Openeye Name: ethyl (5E)-5-[nitroso(phenyl)methylene]-4-phenyl-1,2-dihydropyrazole-3-carboxylate CAS Name: (5E)-5-[nitroso(phenyl)methylidene]-4-phenyl-1,2-dihydropyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[nitroso(phenyl)methylidene]-4-phenyl-1,2-dihydropyrazole-3-carboxylate Traditional Name: (5E)-5-[nitroso(phenyl)methylene]-4-phenyl-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C19H17N3O3 MolecularWeight: 335.35658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C2=CC=CC=C2)N=O)NN1)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(/C(=C(/C2=CC=CC=C2)\N=O)/NN1)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O3/c1-2-25-19(23)18-15(13-9-5-3-6-10-13)17(20-21-18)16(22-24)14-11-7-4-8-12-14/h3-12,20-21H,2H2,1H3/b17-16+