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

Systemtic Name: (3E)-3-[(5-nitro-2-piperidin-1-yl-phenyl)methylidene]-1-benzofuran-2-one Openeye Name: (3E)-3-[[5-nitro-2-(1-piperidyl)phenyl]methylene]benzofuran-2-one CAS Name: (3E)-3-[[5-nitro-2-(1-piperidinyl)phenyl]methylidene]-2-benzofuranone IUPAC Name: (3E)-3-[(5-nitro-2-piperidin-1-ylphenyl)methylidene]-1-benzofuran-2-one Traditional Name: (3E)-3-(5-nitro-2-piperidino-benzylidene)coumaran-2-one Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C=C3C4=CC=CC=C4OC3=O

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])/C=C/3\C4=CC=CC=C4OC3=O

InChI

InChI=1S/C20H18N2O4/c23-20-17(16-6-2-3-7-19(16)26-20)13-14-12-15(22(24)25)8-9-18(14)21-10-4-1-5-11-21/h2-3,6-9,12-13H,1,4-5,10-11H2/b17-13+