2-methylpropyl (2Z)-4,4-diethoxy-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: 2-methylpropyl (2Z)-4,4-diethoxy-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: isobutyl (2Z)-4,4-diethoxy-2-[(3-nitrophenyl)methylene]-3-oxo-butanoate CAS Name: (2Z)-4,4-diethoxy-2-[(3-nitrophenyl)methylidene]-3-oxobutanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2Z)-4,4-diethoxy-2-[(3-nitrophenyl)methylidene]-3-oxobutanoate Traditional Name: (Z)-2-(2,2-diethoxyacetyl)-3-(3-nitrophenyl)acrylic acid isobutyl ester Formula: C19H25NO7 MolecularWeight: 379.4043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO7/c1-5-25-19(26-6-2)17(21)16(18(22)27-12-13(3)4)11-14-8-7-9-15(10-14)20(23)24/h7-11,13,19H,5-6,12H2,1-4H3/b16-11-