6-[(E)-2-nitroprop-1-enyl]-4-(trideuteriomethoxy)-1,3-benzodioxole

Systemtic Name: 6-[(E)-2-nitroprop-1-enyl]-4-(trideuteriomethoxy)-1,3-benzodioxole Openeye Name: 6-[(E)-2-nitroprop-1-enyl]-4-(trideuteriomethoxy)-1,3-benzodioxole CAS Name: 6-[(E)-2-nitroprop-1-enyl]-4-(trideuteriomethoxy)-1,3-benzodioxole IUPAC Name: 6-[(E)-2-nitroprop-1-enyl]-4-(trideuteriomethoxy)-1,3-benzodioxole Traditional Name: 6-[(E)-2-nitroprop-1-enyl]-4-(trideuteriomethoxy)-1,3-benzodioxole Formula: C11H11NO5 MolecularWeight: 240.227225

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC2=C(C(=C1)OC)OCO2)[N+](=O)[O-]

Isomeric SMILES

[2H]C([2H])([2H])OC1=CC(=CC2=C1OCO2)/C=C(\C)/[N+](=O)[O-]

InChI

InChI=1S/C11H11NO5/c1-7(12(13)14)3-8-4-9(15-2)11-10(5-8)16-6-17-11/h3-5H,6H2,1-2H3/b7-3+/i2D3