5-[(E)-2-(4-ethoxyphenyl)ethenyl]-6-nitro-1,3-benzodioxole

Systemtic Name: 5-[(E)-2-(4-ethoxyphenyl)ethenyl]-6-nitro-1,3-benzodioxole Openeye Name: 5-[(E)-2-(4-ethoxyphenyl)vinyl]-6-nitro-1,3-benzodioxole CAS Name: 5-[(E)-2-(4-ethoxyphenyl)ethenyl]-6-nitro-1,3-benzodioxole IUPAC Name: 5-[(E)-2-(4-ethoxyphenyl)ethenyl]-6-nitro-1,3-benzodioxole Traditional Name: 5-nitro-6-[(E)-2-p-phenetylvinyl]-1,3-benzodioxole Formula: C17H15NO5 MolecularWeight: 313.3047

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C17H15NO5/c1-2-21-14-7-4-12(5-8-14)3-6-13-9-16-17(23-11-22-16)10-15(13)18(19)20/h3-10H,2,11H2,1H3/b6-3+