4,5,6-triethoxy-7-nitro-3H-2-benzofuran-1-one

Systemtic Name: 4,5,6-triethoxy-7-nitro-3H-2-benzofuran-1-one Openeye Name: 4,5,6-triethoxy-7-nitro-3H-isobenzofuran-1-one CAS Name: 4,5,6-triethoxy-7-nitro-3H-isobenzofuran-1-one IUPAC Name: 4,5,6-triethoxy-7-nitro-3H-2-benzofuran-1-one Traditional Name: 4,5,6-triethoxy-7-nitro-phthalide Formula: C14H17NO7 MolecularWeight: 311.28728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C2=C1COC2=O)[N+](=O)[O-])OCC)OCC

Isomeric SMILES

CCOC1=C(C(=C(C2=C1COC2=O)[N+](=O)[O-])OCC)OCC

InChI

InChI=1S/C14H17NO7/c1-4-19-11-8-7-22-14(16)9(8)10(15(17)18)12(20-5-2)13(11)21-6-3/h4-7H2,1-3H3