2-(6-nitro-1,3-benzodioxol-5-yl)ethanal

Systemtic Name: 2-(6-nitro-1,3-benzodioxol-5-yl)ethanal Openeye Name: 2-(6-nitro-1,3-benzodioxol-5-yl)acetaldehyde CAS Name: 2-(6-nitro-1,3-benzodioxol-5-yl)acetaldehyde IUPAC Name: 2-(6-nitro-1,3-benzodioxol-5-yl)acetaldehyde Traditional Name: 2-(6-nitro-1,3-benzodioxol-5-yl)acetaldehyde Formula: C9H7NO5 MolecularWeight: 209.15558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7NO5/c11-2-1-6-3-8-9(15-5-14-8)4-7(6)10(12)13/h2-4H,1,5H2