(E)-4-[(3R)-5-(3-nitrophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[(3R)-5-(3-nitrophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[(3R)-5-(3-nitrophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxo-but-2-enoate CAS Name: (E)-4-[(3R)-5-(3-nitrophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxo-2-butenoate IUPAC Name: (E)-4-[(3R)-5-(3-nitrophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-[(5R)-3-(3-nitrophenyl)-5-phenyl-2-pyrazolin-1-yl]but-2-enoate Formula: C19H14N3O5- MolecularWeight: 364.33156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)C=CC(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1[C@@H](N(N=C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)/C=C/C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H15N3O5/c23-18(9-10-19(24)25)21-17(13-5-2-1-3-6-13)12-16(20-21)14-7-4-8-15(11-14)22(26)27/h1-11,17H,12H2,(H,24,25)/p-1/b10-9+/t17-/m1/s1