2,5-bis[(3-ethoxy-5-nitro-4-oxidanyl-phenyl)methylidene]cyclopentan-1-one

Systemtic Name: 2,5-bis[(3-ethoxy-5-nitro-4-oxidanyl-phenyl)methylidene]cyclopentan-1-one Openeye Name: 2,5-bis[(3-ethoxy-4-hydroxy-5-nitro-phenyl)methylene]cyclopentanone CAS Name: 2,5-bis[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]-1-cyclopentanone IUPAC Name: 2,5-bis[(3-ethoxy-4-hydroxy-5-nitrophenyl)methylidene]cyclopentan-1-one Traditional Name: 2,5-bis(3-ethoxy-4-hydroxy-5-nitro-benzylidene)cyclopentanone Formula: C23H22N2O9 MolecularWeight: 470.42878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2CCC(=CC3=CC(=C(C(=C3)OCC)O)[N+](=O)[O-])C2=O

Isomeric SMILES

CCOC1=CC(=CC(=C1O)[N+](=O)[O-])C=C2CCC(=CC3=CC(=C(C(=C3)OCC)O)[N+](=O)[O-])C2=O

InChI

InChI=1S/C23H22N2O9/c1-3-33-19-11-13(9-17(22(19)27)24(29)30)7-15-5-6-16(21(15)26)8-14-10-18(25(31)32)23(28)20(12-14)34-4-2/h7-12,27-28H,3-6H2,1-2H3