(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(4-cyanophenoxy)ethanoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(4-cyanophenoxy)ethanoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(4-cyanophenoxy)acetate CAS Name: 2-(4-cyanophenoxy)acetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(4-cyanophenoxy)acetate Traditional Name: 2-(4-cyanophenoxy)acetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C18H14N2O7 MolecularWeight: 370.31296

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)COC3=CC=C(C=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)COC3=CC=C(C=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O7/c19-7-12-1-3-16(4-2-12)25-10-17(21)26-9-14-6-15(20(22)23)5-13-8-24-11-27-18(13)14/h1-6H,8-11H2