O1-ethyl O5-methyl (4E)-4-[(5-chloranyl-2-nitro-phenyl)methylidene]-2-nitro-pentanedioate

Systemtic Name: O1-ethyl O5-methyl (4E)-4-[(5-chloranyl-2-nitro-phenyl)methylidene]-2-nitro-pentanedioate Openeye Name: O1-ethyl O5-methyl (4E)-4-[(5-chloro-2-nitro-phenyl)methylene]-2-nitro-pentanedioate CAS Name: (4E)-4-[(5-chloro-2-nitrophenyl)methylidene]-2-nitropentanedioic acid O1-ethyl ester O5-methyl ester IUPAC Name: 1-O-ethyl 5-O-methyl (4E)-4-[(5-chloro-2-nitrophenyl)methylidene]-2-nitropentanedioate Traditional Name: (4E)-4-(5-chloro-2-nitro-benzylidene)-2-nitro-glutaric acid O1-ethyl ester O5-methyl ester Formula: C15H15ClN2O8 MolecularWeight: 386.7412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=CC1=C(C=CC(=C1)Cl)[N+](=O)[O-])C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C/C(=C\C1=C(C=CC(=C1)Cl)[N+](=O)[O-])/C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H15ClN2O8/c1-3-26-15(20)13(18(23)24)8-10(14(19)25-2)6-9-7-11(16)4-5-12(9)17(21)22/h4-7,13H,3,8H2,1-2H3/b10-6+