(E)-3-(1,3-benzodioxol-5-yl)-2-nitro-prop-2-enal

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitro-prop-2-enal Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitro-prop-2-enal CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitro-2-propenal IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitroprop-2-enal Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitro-acrolein Formula: C10H7NO5 MolecularWeight: 221.16628

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C=O)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C=O)/[N+](=O)[O-]

InChI

InChI=1S/C10H7NO5/c12-5-8(11(13)14)3-7-1-2-9-10(4-7)16-6-15-9/h1-5H,6H2/b8-3+