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

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitro-prop-2-en-1-ol Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitro-prop-2-en-1-ol CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitro-2-propen-1-ol IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitroprop-2-en-1-ol Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-nitro-prop-2-en-1-ol Formula: C10H9NO5 MolecularWeight: 223.18216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO5/c12-5-8(11(13)14)3-7-1-2-9-10(4-7)16-6-15-9/h1-4,12H,5-6H2/b8-3+