diethyl (2E)-2-[(4-chlorophenyl)methylidene]-4-nitro-pentanedioate

Systemtic Name: diethyl (2E)-2-[(4-chlorophenyl)methylidene]-4-nitro-pentanedioate Openeye Name: diethyl (2E)-2-[(4-chlorophenyl)methylene]-4-nitro-pentanedioate CAS Name: (2E)-2-[(4-chlorophenyl)methylidene]-4-nitropentanedioic acid diethyl ester IUPAC Name: diethyl (2E)-2-[(4-chlorophenyl)methylidene]-4-nitropentanedioate Traditional Name: (2E)-2-(4-chlorobenzylidene)-4-nitro-glutaric acid diethyl ester Formula: C16H18ClNO6 MolecularWeight: 355.77022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClNO6/c1-3-23-15(19)12(9-11-5-7-13(17)8-6-11)10-14(18(21)22)16(20)24-4-2/h5-9,14H,3-4,10H2,1-2H3/b12-9+