5-[(E)-3-nitrobut-1-enyl]-1,3-benzodioxole

Systemtic Name: 5-[(E)-3-nitrobut-1-enyl]-1,3-benzodioxole Openeye Name: 5-[(E)-3-nitrobut-1-enyl]-1,3-benzodioxole CAS Name: 5-[(E)-3-nitrobut-1-enyl]-1,3-benzodioxole IUPAC Name: 5-[(E)-3-nitrobut-1-enyl]-1,3-benzodioxole Traditional Name: 5-[(E)-3-nitrobut-1-enyl]-1,3-benzodioxole Formula: C11H11NO4 MolecularWeight: 221.20934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO4/c1-8(12(13)14)2-3-9-4-5-10-11(6-9)16-7-15-10/h2-6,8H,7H2,1H3/b3-2+