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

Systemtic Name: diethyl (2E)-2-[(4-methylphenyl)methylidene]-4-nitro-pentanedioate Openeye Name: diethyl (4E)-2-nitro-4-(p-tolylmethylene)pentanedioate CAS Name: (2E)-2-[(4-methylphenyl)methylidene]-4-nitropentanedioic acid diethyl ester IUPAC Name: diethyl (2E)-2-[(4-methylphenyl)methylidene]-4-nitropentanedioate Traditional Name: (2E)-2-(4-methylbenzylidene)-4-nitro-glutaric acid diethyl ester Formula: C17H21NO6 MolecularWeight: 335.35174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO6/c1-4-23-16(19)14(10-13-8-6-12(3)7-9-13)11-15(18(21)22)17(20)24-5-2/h6-10,15H,4-5,11H2,1-3H3/b14-10+