diethyl 2-[[3-(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)-5-nitro-phenyl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[3-(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)-5-nitro-phenyl]methylidene]propanedioate Openeye Name: diethyl 2-[[3-(3-ethoxy-2-ethoxycarbonyl-3-oxo-prop-1-enyl)-5-nitro-phenyl]methylene]propanedioate CAS Name: 2-[[3-(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)-5-nitrophenyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3-(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)-5-nitrophenyl]methylidene]propanedioate Traditional Name: 2-[3-(2-carbethoxy-3-ethoxy-3-keto-prop-1-enyl)-5-nitro-benzylidene]malonic acid diethyl ester Formula: C22H25NO10 MolecularWeight: 463.4346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO10/c1-5-30-19(24)17(20(25)31-6-2)12-14-9-15(11-16(10-14)23(28)29)13-18(21(26)32-7-3)22(27)33-8-4/h9-13H,5-8H2,1-4H3