(4E)-3-azanyl-4-[(2-morpholin-4-yl-5-nitro-phenyl)methylidene]-1H-pyrazol-5-one

Systemtic Name: (4E)-3-azanyl-4-[(2-morpholin-4-yl-5-nitro-phenyl)methylidene]-1H-pyrazol-5-one Openeye Name: (4E)-3-amino-4-[(2-morpholino-5-nitro-phenyl)methylene]-1H-pyrazol-5-one CAS Name: (4E)-3-amino-4-[[2-(4-morpholinyl)-5-nitrophenyl]methylidene]-1H-pyrazol-5-one IUPAC Name: (4E)-3-amino-4-[(2-morpholin-4-yl-5-nitrophenyl)methylidene]-1H-pyrazol-5-one Traditional Name: (4E)-5-amino-4-(2-morpholino-5-nitro-benzylidene)-2-pyrazolin-3-one Formula: C14H15N5O4 MolecularWeight: 317.3

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=C3C(=NNC3=O)N

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])/C=C/3\C(=NNC3=O)N

InChI

InChI=1S/C14H15N5O4/c15-13-11(14(20)17-16-13)8-9-7-10(19(21)22)1-2-12(9)18-3-5-23-6-4-18/h1-2,7-8H,3-6H2,(H2,15,16)(H,17,20)/b11-8+