(3Z,5E)-3,5-bis[(4-nitro-3-oxidanyl-phenyl)methylidene]-1-(phenylmethyl)piperidin-4-one

Systemtic Name: (3Z,5E)-3,5-bis[(4-nitro-3-oxidanyl-phenyl)methylidene]-1-(phenylmethyl)piperidin-4-one Openeye Name: (3Z,5E)-1-benzyl-3,5-bis[(3-hydroxy-4-nitro-phenyl)methylene]piperidin-4-one CAS Name: (3Z,5E)-3,5-bis[(3-hydroxy-4-nitrophenyl)methylidene]-1-(phenylmethyl)-4-piperidinone IUPAC Name: (3Z,5E)-1-benzyl-3,5-bis[(3-hydroxy-4-nitrophenyl)methylidene]piperidin-4-one Traditional Name: (3Z,5E)-1-benzyl-3,5-bis(3-hydroxy-4-nitro-benzylidene)-4-piperidone Formula: C26H21N3O7 MolecularWeight: 487.46084

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=CC(=C(C=C2)[N+](=O)[O-])O)C(=O)C(=CC3=CC(=C(C=C3)[N+](=O)[O-])O)CN1CC4=CC=CC=C4

Isomeric SMILES

C1/C(=C\C2=CC(=C(C=C2)[N+](=O)[O-])O)/C(=O)/C(=C\C3=CC(=C(C=C3)[N+](=O)[O-])O)/CN1CC4=CC=CC=C4

InChI

InChI=1S/C26H21N3O7/c30-24-12-18(6-8-22(24)28(33)34)10-20-15-27(14-17-4-2-1-3-5-17)16-21(26(20)32)11-19-7-9-23(29(35)36)25(31)13-19/h1-13,30-31H,14-16H2/b20-10-,21-11+