(4E)-4-[(3-nitro-4-piperidin-1-yl-phenyl)methylidene]-2-phenyl-1,3-oxazol-5-one

Systemtic Name: (4E)-4-[(3-nitro-4-piperidin-1-yl-phenyl)methylidene]-2-phenyl-1,3-oxazol-5-one Openeye Name: (4E)-4-[[3-nitro-4-(1-piperidyl)phenyl]methylene]-2-phenyl-oxazol-5-one CAS Name: (4E)-4-[[3-nitro-4-(1-piperidinyl)phenyl]methylidene]-2-phenyl-5-oxazolone IUPAC Name: (4E)-4-[(3-nitro-4-piperidin-1-ylphenyl)methylidene]-2-phenyl-1,3-oxazol-5-one Traditional Name: (4E)-4-(3-nitro-4-piperidino-benzylidene)-2-phenyl-2-oxazolin-5-one Formula: C21H19N3O4 MolecularWeight: 377.39326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C=C3C(=O)OC(=N3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)/C=C/3\C(=O)OC(=N3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O4/c25-21-17(22-20(28-21)16-7-3-1-4-8-16)13-15-9-10-18(19(14-15)24(26)27)23-11-5-2-6-12-23/h1,3-4,7-10,13-14H,2,5-6,11-12H2/b17-13+