3-[(3E,5E)-3,5-bis[(4-nitrophenyl)methylidene]-4-oxidanylidene-piperidin-1-yl]propyl-ethoxy-phosphinic acid

Systemtic Name: 3-[(3E,5E)-3,5-bis[(4-nitrophenyl)methylidene]-4-oxidanylidene-piperidin-1-yl]propyl-ethoxy-phosphinic acid Openeye Name: 3-[(3E,5E)-3,5-bis[(4-nitrophenyl)methylene]-4-oxo-1-piperidyl]propyl-ethoxy-phosphinic acid CAS Name: 3-[(3E,5E)-3,5-bis[(4-nitrophenyl)methylidene]-4-oxo-1-piperidinyl]propyl-ethoxyphosphinic acid IUPAC Name: 3-[(3E,5E)-3,5-bis[(4-nitrophenyl)methylidene]-4-oxopiperidin-1-yl]propyl-ethoxyphosphinic acid Traditional Name: ethoxy-[3-[(3E,5E)-4-keto-3,5-bis(4-nitrobenzylidene)piperidino]propyl]phosphinic acid Formula: C24H26N3O8P MolecularWeight: 515.452301

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCCN1CC(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(=CC3=CC=C(C=C3)[N+](=O)[O-])C1)O

Isomeric SMILES

CCOP(=O)(O)CCCN1C/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/C1

InChI

InChI=1S/C24H26N3O8P/c1-2-35-36(33,34)13-3-12-25-16-20(14-18-4-8-22(9-5-18)26(29)30)24(28)21(17-25)15-19-6-10-23(11-7-19)27(31)32/h4-11,14-15H,2-3,12-13,16-17H2,1H3,(H,33,34)/b20-14+,21-15+